jmlr jmlr2007 jmlr2007-59 knowledge-graph by maker-knowledge-mining

59 jmlr-2007-Nonlinear Boosting Projections for Ensemble Construction


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Author: Nicolás García-Pedrajas, César García-Osorio, Colin Fyfe

Abstract: In this paper we propose a novel approach for ensemble construction based on the use of nonlinear projections to achieve both accuracy and diversity of individual classifiers. The proposed approach combines the philosophy of boosting, putting more effort on difficult instances, with the basis of the random subspace method. Our main contribution is that instead of using a random subspace, we construct a projection taking into account the instances which have posed most difficulties to previous classifiers. In this way, consecutive nonlinear projections are created by a neural network trained using only incorrectly classified instances. The feature subspace induced by the hidden layer of this network is used as the input space to a new classifier. The method is compared with bagging and boosting techniques, showing an improved performance on a large set of 44 problems from the UCI Machine Learning Repository. An additional study showed that the proposed approach is less sensitive to noise in the data than boosting methods. Keywords: classifier ensembles, boosting, neural networks, nonlinear projections

Reference: text


Summary: the most important sentenses genereted by tfidf model

sentIndex sentText sentNum sentScore

1 UK School of Computing University of Paisley Paisley, United Kingdom Editor: Dale Schuurmans Abstract In this paper we propose a novel approach for ensemble construction based on the use of nonlinear projections to achieve both accuracy and diversity of individual classifiers. [sent-6, score-0.422]

2 In this way, consecutive nonlinear projections are created by a neural network trained using only incorrectly classified instances. [sent-9, score-0.182]

3 The feature subspace induced by the hidden layer of this network is used as the input space to a new classifier. [sent-10, score-0.199]

4 The method is compared with bagging and boosting techniques, showing an improved performance on a large set of 44 problems from the UCI Machine Learning Repository. [sent-11, score-0.342]

5 Introduction An ensemble of classifiers consists of a combination of different classifiers, homogeneous or heterogeneous, to jointly perform a classification task. [sent-14, score-0.242]

6 In a classifier ensemble framework we have a set of classifiers = {C1 ,C2 , . [sent-29, score-0.242]

7 Many methods have been developed to enforce diversity on the classifiers that form the ensemble (Dietterich, 2000c). [sent-45, score-0.34]

8 On the other hand, bagging seems to be more efficient in reducing bias than A DA B OOST (Bauer and Kohavi, 1999). [sent-56, score-0.234]

9 Although these techniques are focused on obtaining as diverse classifiers as possible, without deteriorating the accuracy of each classifier, Kuncheva and Whitaker (2003) failed to establish a clear relationship between diversity and ensemble performance. [sent-57, score-0.34]

10 Cherkauer (1996) trained an ensemble of classifiers which consisted of 32 neural networks trained using 8 different subsets of input features together with 4 different network sizes. [sent-79, score-0.346]

11 Tumer and Ghosh (1996) used a similar technique to classify sonar signals, but they found that removing just a few of the input features hurts the performance of the classifiers so much that the resulting ensemble had a poor performance. [sent-82, score-0.305]

12 As an useful alternative, evolutionary computation has also been successfully applied to ensemble construction. [sent-85, score-0.266]

13 (2002) used a genetic algorithm to obtain a subset of an ensemble of classifiers that was able to outperform the ensemble using all the classifiers. [sent-87, score-0.484]

14 (2005) developed a cooperative coevolutionary method for ensemble construction with excellent results on classification problems. [sent-91, score-0.242]

15 In summary, the construction of ensembles aims to fulfil two different objectives: accuracy of classifiers and diversity among them. [sent-94, score-0.188]

16 So, our approach is based on combining the main ideas underlying boosting and random subspace methods, namely: • All the classifiers should receive all the training instances for learning, and all of them are equally weighted. [sent-104, score-0.192]

17 • Following the basic principles of boosting, each nonlinear projection is constructed in order to make the classification of difficult instances easier. [sent-108, score-0.18]

18 Our approach is based on the use of the projection carried out by the hidden layer of a multilayer perceptron neural network when it is used for classification purposes. [sent-123, score-0.253]

19 Let us consider a feed-forward neural network with D inputs and a hidden layer with H nodes. [sent-143, score-0.178]

20 The hidden layer carries out a non linear projection of input vector x to a vector h where: D hi = f ∑ wi j x j , x0 = 1. [sent-144, score-0.197]

21 This projection performed by the hidden layer of a multi-layer perceptron distorts the data structure and inter-instance distances (Lerner et al. [sent-148, score-0.197]

22 So, the projection performed by the hidden layer focuses on making the classification of the instances easier. [sent-150, score-0.26]

23 Our approach to obtain a projection focused on making the classification of difficult instances easier consists of training a neural network with only the instances that have been incorrectly classified by the previous classifier. [sent-151, score-0.277]

24 The number of hidden nodes of the network is the same as the number of input variables, so the hidden layer is performing a nonlinear projection into a space of the same dimension as the input space. [sent-152, score-0.345]

25 As the network has been trained only with a 5 G ARC´A -P EDRAJAS , G ARC´A -O SORIO AND F YFE I I subset of the training instances, the projection performed by the hidden layer focuses on making the classification of only this subset easier. [sent-153, score-0.277]

26 Once the network is trained, the projection implemented by the hidden layer is used to project all the data set, and these projections are fed to the new classifier to be trained. [sent-154, score-0.293]

27 The proposed algorithm has not incorporated any other ensemble construction method, that may improve its performance, in order not to obscure its behaviour. [sent-165, score-0.242]

28 Train network H with S and get projection P(x) implemented by the hidden layer of H. [sent-173, score-0.253]

29 Although we need to train an additional neural network for each new classifier of the ensemble, except the first one, the additional complexity of this training process is diminished by the fact that the projection network is trained using only the instances misclassified by the previous classifier. [sent-176, score-0.274]

30 To avoid confusion, we must remark that the network trained using the misclassified instances is not part of the ensemble, and only the projection carried out by its hidden layer is used. [sent-178, score-0.34]

31 Using these two data sets we run our algorithm and A DA B OOST with an ensemble of 50 classifiers and a neural network, a C4. [sent-182, score-0.242]

32 8 1 Test set Figure 1: Training and testing data for a two-dimensional problem of two classes with two likely mislabelled noisy instances The example illustrates the differences of our method with boosting methods and how these differences may constitute an advantage. [sent-201, score-0.171]

33 1250 Table 1: Summary of training and test error results for the toy problem with an ensemble of 50 classifiers. [sent-220, score-0.242]

34 Related Work The use of different spaces for ensemble construction has been extensive in recent research. [sent-222, score-0.242]

35 Opitz (1999) developed accurate and diverse classifiers for an ensemble using ensemble feature selection. [sent-228, score-0.484]

36 In contrast to classical feature selection algorithms, that are focused on finding the best feature subset for a given classifier, ensemble feature selection adds an additional objective of promoting disagreement among the individual classifiers. [sent-229, score-0.242]

37 Different strategies have been proposed to ensemble feature selection, such as hill climbing (Kohavi, 1995; Cunningham and Carney, 2000), a genetic algorithm (Opitz, 1999), and the heuristic method Ensemble Forward and Backward Sequential Selection (Aha and Bankert, 1995). [sent-230, score-0.242]

38 Utsugi (2001) proposed an ensemble of independent factor analysers (Anderson, 1984). [sent-233, score-0.242]

39 Experiments In order to test the performance of our method on solving classification tasks, we need to compare it with other widely used ensemble methods. [sent-243, score-0.242]

40 The first two have been widely used for ensemble construction in the literature. [sent-247, score-0.242]

41 The last one has been shown recently to achieve good results as a member of an ensemble (Kim et al. [sent-248, score-0.242]

42 The network has a hidden layer of 25 nodes and hyperbolic tangent transfer function for the hidden layer and logistic transfer function for the output layer. [sent-257, score-0.3]

43 Before deciding upon bagging we tested its performance against wagging. [sent-265, score-0.234]

44 Wagging is a variant of bagging (Breiman, 1996a) that requires a learning algorithm that can use training instances with different weights. [sent-266, score-0.297]

45 In a preliminary set of experiments we compared the performance of bagging and wagging, and found that bagging significantly outperformed wagging, so in all the experiments we have used bagging. [sent-273, score-0.468]

46 For the three base learners we make a preliminary test to compare resampling and reweighting versions of the boosting algorithms. [sent-288, score-0.206]

47 9 G ARC´A -P EDRAJAS , G ARC´A -O SORIO AND F YFE I I each ensemble taking into account either the problem or the type of base learner is computationally unfeasible. [sent-305, score-0.332]

48 Moreover, it is known (Zenobi and Cunningham, 2001) that the diversity and the accuracy of the ensemble usually plateau at some size between 10 and 50 members. [sent-306, score-0.34]

49 Furthermore, for A DA B OOST the error bound of the training error is almost 0 after the addition of about 30 classifiers to the ensemble (Kuncheva, 2003), so 50 is a widely used ensemble size. [sent-308, score-0.484]

50 2 Experimental Results In the first set of experiments we tested our method against the standard ensemble methods. [sent-338, score-0.242]

51 As a summary, NLBP is able to significantly improve bagging in 16 data sets, AdaBoost in 13, MadaBoost in 17 and Arc-x4 in 14. [sent-353, score-0.234]

52 The results in Table 5 show that, for a SVM as base classifier, the proposed method is significantly better than bagging in 19 data sets, than A DA B OOST in 23 data sets, than M ADA B OOST in 16 and than Arc-x4 in 21 data sets. [sent-362, score-0.303]

53 As a summary, for all the three classifiers NLBP is able to obtain very good results, outperforming both bagging and boosting methods. [sent-366, score-0.342]

54 Analysis of the Proposed Method In the previous section we have shown that the nonlinear projection approach is very competitive when compared with the standard methods of ensemble construction. [sent-369, score-0.359]

55 The behaviour of NLBP shown by κ-error diagrams suggests a further study on the sensitivity to noise of the method; that study is performed for all the data sets used in the previous experiments, and the three base classifiers. [sent-373, score-0.237]

56 12 N ONLINEAR B OOSTING P ROJECTIONS FOR E NSEMBLE C ONSTRUCTION Data Set NLBP Standard ensemble methods Bagging AdaB. [sent-376, score-0.242]

57 0651 17/0 Table 3: Summary of test error results for ensembles using a neural network as base learner and 5x2cv. [sent-686, score-0.236]

58 13 G ARC´A -P EDRAJAS , G ARC´A -O SORIO AND F YFE I I Data Set NLBP Standard ensemble methods Bagging AdaBoost MadaBoost anneal 0. [sent-687, score-0.303]

59 14 N ONLINEAR B OOSTING P ROJECTIONS FOR E NSEMBLE C ONSTRUCTION Data Set NLBP Standard ensemble methods Bagging AdaBoost MadaBoost anneal 0. [sent-910, score-0.303]

60 0575 21/1 Table 5: Summary of test error results ensembles with using a SVM as base learner and 5x2cv. [sent-1131, score-0.18]

61 It is known that the use of random subspaces is able to improve the performance of an ensemble (Ho, 1998), and it is possible that the use of different projections of the original data, no matter how they are obtained, could be the cause of the good performance of NLBP. [sent-1133, score-0.305]

62 So we have trained the classifiers that make up the ensemble using a different nonlinear random projection for each classifier. [sent-1134, score-0.383]

63 The random nonlinear projection is obtained using the same neural network used in NLBP, but with the weights randomly initialised in the interval [−1, 1] and no training. [sent-1135, score-0.173]

64 For a neural network NLBP is significantly better than a random projection in 16 data sets, and better than the projection using all the instances in 20 data sets. [sent-1141, score-0.269]

65 2 κ - Error Diagrams One way of understanding the behaviour of ensemble methods is by means of a κ-error diagram (Margineantu and Dietterich, 1997; Dietterich, 2000a). [sent-1145, score-0.312]

66 For all the three base classifiers we verify the usual behaviour of bagging and boosting methods. [sent-1561, score-0.459]

67 With this three levels of noise we have performed the experiments using the 5x2cv setup and NLBP, bagging and A DA B OOST ensemble methods and compared the results as the level of noise increases. [sent-1575, score-0.566]

68 For the noise study we have used bagging and A DA B OOST as the representative of the boosting methods (for neural networks the used method is A DA B OOST. [sent-1576, score-0.387]

69 First of all, we can corroborate that tables confirm that bagging is less affected by noise than boosting, as has been shown in several papers, for example, (Dietterich, 2000a). [sent-1580, score-0.279]

70 For 10% of noise the performance of bagging improves, achieving a win/loss record of 13/3 with NLBP, better than the record without noise, 17/0. [sent-1586, score-0.353]

71 5 1 Figure 2: κ-error diagram for the data sets using the five ensemble methods and a neural network as base learner. [sent-1686, score-0.389]

72 5 1 Figure 3: κ-error diagram for the data sets using the five ensemble methods and a C4. [sent-1779, score-0.264]

73 5 1 Figure 4: κ-error diagram for the data sets using the five ensemble methods and a SVM as base learner. [sent-1873, score-0.333]

74 When the noise level is 20% the effect is more marked for both algorithms, with a record of 18/3 for bagging and 25/1 for A DA B OOST. [sent-1881, score-0.316]

75 But the case of bagging is slightly different from the two previous classifiers. [sent-1885, score-0.234]

76 With a SVM bagging is less affected by noise, even improving its compared performance with NLBP; for a noise level of 20% bagging is worse than NLBP in only 11 data sets. [sent-1886, score-0.513]

77 In summary, NLBP has the very desirable property of behaving, at least, as robustly as bagging in the presence of noise. [sent-1887, score-0.234]

78 This is probably due to the fact that NLBP does not put so much emphasis on incorrectly classified instances as boosting does. [sent-1888, score-0.191]

79 These two arguments together support the use of an ensemble of fixed size of 50 base classifiers as reasonable, and that it is not likely that the size of the ensemble might contaminate the experimental results. [sent-1893, score-0.553]

80 Nevertheless, it is possible that for some of the problems the ensemble may be either overfitting or underfitting the data. [sent-1894, score-0.242]

81 So, we have performed an additional experiment where the size of the ensemble is obtained by a cross-validation strategy. [sent-1895, score-0.242]

82 For each partition of each problem we perform a 5-fold cross-validation to obtain the optimal size of the ensemble within the range of [10, 100] classifiers. [sent-1898, score-0.242]

83 That is, we divide the training set into five partitions and train the ensemble with four partitions and test the error with the remaining one. [sent-1899, score-0.242]

84 This is repeated for each one of the five partitions, and the ensemble size is obtained as the average size of the 5 runs. [sent-1900, score-0.242]

85 Then, the algorithm is run with this optimal size of the ensemble and using the whole training set. [sent-1901, score-0.242]

86 As the size of the ensemble is estimated for each partition, overfitting or underfitting is less likely to happen. [sent-1902, score-0.242]

87 2773 20/2 Table 7: Summary of test error results for ensembles with a neural network using 5x2cv with noise levels of 5%, 10%, and 20%. [sent-2313, score-0.191]

88 5 tree and a SVM as base classifiers and the size of the ensemble obtained by cross-validation. [sent-3388, score-0.336]

89 We can say that the conclusions obtained using 50 classifiers also hold for the results obtained estimating the size of the ensemble by cross-validation. [sent-3390, score-0.242]

90 Conclusions and Future Work In this paper we have presented a new approach for ensemble construction based on nonlinear projections of the original training instances. [sent-3396, score-0.324]

91 This improvement of performance has been assessed using ensembles of fixed size and ensembles of variable size obtained by cross-validation. [sent-3406, score-0.18]

92 We believe that this work opens a new and interesting approach to ensemble construction. [sent-3409, score-0.242]

93 Secondly, we have experienced some problems with the use of a neural network for the non-linear projections, due to the facility with which the outputs of the hidden nodes of the network saturate, making the projection less efficient. [sent-3415, score-0.237]

94 27 G ARC´A -P EDRAJAS , G ARC´A -O SORIO AND F YFE I I Data Set anneal audiology autos balance breast-c card dermatol. [sent-3417, score-0.29]

95 ecoli gene german glass glass-g2 heart heart-c hepatitis horse ionosph. [sent-3418, score-0.385]

96 optdigits page-b pendigits phoneme pima primary-t promoters satimage segment sick sonar soybean vehicle vote vowel waveform yeast zip zoo Neural network NLBP A DA B OOST. [sent-3420, score-1.085]

97 5 tree and a SVM as base classifiers and the size of the ensemble obtained by cross-validation. [sent-3687, score-0.336]

98 Measures of diversity in classifier ensembles and their relationship with the ensemble accuracy. [sent-3948, score-0.43]

99 Search strategies for ensemble feature selection in medical diagnosis. [sent-4101, score-0.242]

100 Using diversity in preparing ensembles of classifiers based on different feature subsets to minimize generalization error. [sent-4132, score-0.188]


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Figure 3 shows the training set evolution for the two-spirals problem (in Figure 1a) in various training stages. The network topology was 2:64:1. You can see the training set forming gradually and tracing the problem boundaries where the error is the highest. One could argue that such a process may be very sensitive to outliers. Experiments have shown that this does not happen. The algorithm does not try to recognize the outliers, but at least, adjusts naturally by not allowing the training set size to shrink. So, at the presence of heavy noise, the algorithm becomes ineffective, but does not introduce any additional harm. Figure 4 shows the two2019 C HARIATIS 10000-11840-93% 20000-25755-76% 40000-66656-41% 60000-142789-22% 90000-296659-18% Figure 3: Training set evolution for the two-spirals problem. Under each image you can see the stage of training in trains, error-evaluations and the percentage of samples for which training is performed at the corresponding stage. spirals problem distorted by dynamic noise and the corresponding training set after 90000 trains with 64 hidden units. You can see that the algorithm tolerates noise by not allowing the training set size to shrink. It is also interesting that at noise levels as high as 30% the algorithm can still exclude large areas of the input space from training. 10%-42% 20%-62% 30%-75% 50%-93% 70%-99% Figure 4: Top row shows the model with a visualization of the applied dynamic noise. Bottom row shows the corresponding training sets after 90000 trains. Under each pair of images you can see the percentage of noise distortion applied to the original input and the percentage of samples for which training is performed. 3. Local Selective Attention - Receptive Fields Having established a global method to focus attention on the important parts of a problem, we now come to address the main issue, which is the network training. Let first discuss the roles of the hidden and output layers in a feed forward neural network with a single hidden layer and without shortcut input-to-output connections. 2020 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS The hidden layer is responsible for transforming a non linear input-to-output mapping, into a non linear input-to-hidden layer mapping, that can be mapped linearly to the output. The output layer is responsible for learning a linear hidden-to-output mapping (which is an easy job), but most importantly, it must provide to the hidden layer error gradient information that will be used for the error credit assignment problem. In this respect, it becomes apparent that all hidden units should receive the most possibly accurate error information. That is why, we must train all hidden to output connections and back propagate the error through all these connections. This is not the case for the hidden layer. Consider, for a classification problem, how the hidden units with sigmoidal activations partition the input space into sub areas. By adjusting the input-tohidden weights and biases, each hidden unit develops a hyperplane that bi-partitions the input space in the most useful sense. We would like to limit the number of hyperplanes in order to reduce the system’s available degrees of freedom and obtain better generalization capabilities. At the same time, we would like to thoroughly use them in order to optimize the input output approximation. This can be done by arranging the hyperplanes to touch the problem’s boundaries at regular intervals dictated by the boundary curvature, as it is shown in Figure 5a. Figure 5b, shows a suboptimal placement of the hyperplanes which causes a waste of resources. Each hidden unit must be differentiated from the others and ideally not interfere with the subproblems that the other units are trying to solve. Suppose that two hidden units are governed by the same, or nearly the same, parameters. How can we differentiate them? There are many possibilities. (a) (b) Figure 5: Optimal vs. suboptimal hyperplanes. One could be, to just throw one unit away and make the output weight of the other equal to the sum of the two original output weights. That would leave the function unchanged. However, identifying these similar units during training is not easy computationally. In addition, we would have to figure out a method that would compute the best initial placement for the hyperplane of the new unit that would substitute the one that was thrown away. Another possibility would be to add noise in the weight updates, gradually reduced with a simulated annealing schedule which should be decided before training begins. Unfortunately, the loss of initial state invariance would complicate training for unknown complex non linear problems. To our thinking, it is much better to embed constraints into the system, so that it will not be possible for two hidden units to develop the same hyperplane. Two computationally efficient techniques to embed such constraints are described in sections 3.1 and 3.2. Many other authors have also examined methods for local selective attention. For the related discussions see Huang and Huang (1990), Ahmad and Omohundro (1990), Baluja and Pomerleau (1995), Flake (1998), Duch et al. (1998), and Phillips and Noelle (2004). 2021 C HARIATIS 3.1 Fixed Cascaded Inhibitory Connections A problem with the hidden units of conventional feed forward networks is that they are all fed with the same inputs and back propagated errors and that they operate without knowing each other’s existence. So, nothing prevents them from behaving identically. This lack of communication between hidden units has been addressed by researchers through hidden unit lateral connections. Agyepong and Kothari (1997) use unidirectional lateral interconnections between adjacent hidden layer units, claiming that these connections facilitate the controlled assignment of role and specialization of the hidden units. Kothari and Ensley (1998) use Gaussian lateral connections which enable the hidden decision boundaries to be global in nature but also be able to represent local structure. Numerous neural network algorithms employ bidirectional lateral inhibitory connections in order to generate competition between the hidden units. In an interesting variation described by Spratling and Johnson (2004), competition is provided by each hidden unit blocking its preferred inputs from activating other units. We use a single hidden layer where the hidden units are considered sequenced. Each hidden unit is connected to all succeeding hidden units with a fixed connection with weight set to minus one. The hidden units get differentiated, because they receive different inputs, they produce different activations and they get back different error information. Another benefit is that they can generate higher order feature detectors, that is, the resulting hidden hyperplanes are no longer strictly linear, but they may also be curved. Considering the fixed value, -1 is used just to avoid a multiplication. Values from -0.5 to -2 give good results as well. As it is shown in Section 5.1.1, the fixed cascaded inhibitory connections are very effective at reducing a problem’s asymptotic residual error. This should be attributed to both of their abilities, to generate higher order feature detectors and to hasten the hidden units’ symmetry breaking. These connections can be implemented very efficiently with just one subtraction per hidden unit for both hidden activation and hidden error computation. In addition, the disturbance to the parallelism of the backpropagation algorithm is minimal. Most operations on the hidden units can still be done in parallel and only the final computations must be performed sequentially. We include the algorithms for the hidden activation and error computations as examples of sequential implementations. These changes can be very easily incorporated into conventional neural network code. Hidden Activations δ←0 For j ← 1 . . . η nj ← δ+x·wj h j ← f (n j ) δ ← δ−hj End Hidden Error Signals δ←0 For j ← η . . . 1 ej ← δ+r ·uj g j ← e j f (n j ) δ ← δ−gj End Algorithm 2: Hidden unit activation and error computation with Fixed Cascaded -1 Connections. 2022 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS 3.2 Selective Training of the Hidden Units The hidden units’ differentiation can be farther magnified if each unit is not trained on all samples, but only on the samples for which it receives a high error. We train all output units, but only the hidden units for which the error signal is higher than the RMS of the error signals of all hidden units. Typically about 10% of the hidden units are trained on each sample during early training and the percentage falls up to 2% when the network is close to the solution. This is intuitively justified by the observation that at the beginning of training the hidden units are largely undifferentiated and receive high error signals from the whole input space. At the final stage of training, the hidden hyperplanes’ linear soft decision boundaries are combined by the output layer to define arbitrarily shaped decision boundaries. For µ input dimensions, from 1 up to µ units can define an open sub-region and µ + 1 units are enough to define a closed convex region. With such high level constructs, each sample may be discriminated from the rest with very few hidden units. These, are the units that receive the highest error signal for the sample. Experiments on various problems have shown that training on a fraction of the hidden units is always better (in respect to number of trains to convergence), than training all or just one hidden unit. It seems that training only one hidden unit on each sample is not sufficient for some problems (Thornton, 1992). Measurements for one of these experiments are reported in Section 5.1.1. In addition to the convergence acceleration, the combined effect of training a fraction of the hidden units on a fraction of the samples, gives big savings in CPU usage per sample as well. This sparseness of training in respect to evaluation provides further opportunities for speedup as it is discussed in Section 4. 3.3 Centering On The Input Space It is a well known recommendation (Schraudolph, 1998a,b; LeCun et al., 1998) that the input values should be normalized to have zero mean and unit standard deviation over each input dimension. This is achieved by subtracting from each input value the mean and dividing by the standard deviation. For some problems, like the one in Figure 2b, the center of the input space is not equal to the center of the problem. When the input is not known in advance, the later must be computed adaptively. Moreover, since the hidden units are trained on different input samples, we should compute for each hidden unit its own mean and standard deviation over each input dimension. For the connection between hidden unit j and input unit i we can adaptively compute the approximate mean m ji and standard deviation s ji over the inputs that train the hidden unit, using either exponential traces: m ji (t) ← β xi + (1 − β) m ji (t−1) , q ji (t) ← β xi2 + (1 − β) q ji (t−1) , s ji (t) ← (q ji (t) − m ji 2 )1/2 , (t) or perturbated calculations: m ji (t) ← m ji (t−1) + β (xi − m ji (t−1) ), v ji (t) ← v ji (t−1) + β (xi − m ji (t) ) (xi − m ji (t−1) ) − v ji (t−1) , 2023 C HARIATIS 1/2 s ji (t) ← v ji (t) , where β is a constant that determines the time scale of exponential averaging, vector x holds the input values, matrix Q holds the means of the squared input values and matrix V holds the variances. The means and standard deviations of a hidden unit’s input connections are updated only when the hidden unit is trained. The result of this treatment is that each hidden unit is centered on a different part of the input space. This center is indirectly affected by the error that the inputs produce on the hidden unit. The magnitude of the constant β is problem specific, but in all experiments in this report it was kept fixed to 10−3 . This constant must be selected large enough, so that the centers will rapidly move to their optimum locations, and small enough, so that the hidden units will see a relatively static view of the input space and the gradient descent algorithm will not be confused. As the hidden units jitter around their centers, we effectively train them on slightly shifted views of the input space, something that can assist generalization. We get something analogous to training with jitter (Reed et al., 1995), at no extra cost. In Figure 6, the squares show where each hidden unit is centered. You can see that most are centered on the problem boundaries at regular intervals. The crosses show the standard deviations. On some directions the standard deviations are very small, which results in very high normalized input values, causing the hidden units to act as threshold units at those directions. The sloped lines show the hyperplane distance from center and the slope. These are computed for display purposes, from their theoretical formulas for a conventional network, without considering the effect of the cascaded connections. For some units the hyperplanes shown are not exactly on the boundaries. This is because of the fixed cascaded connections that cause the hidden units to be not exactly linear discriminants. In the last picture you can see the decision surface of a hidden unit which is a bit curved and coincides with the class boundary although its calculated hyperplane is not on the boundary. An observant reader may also notice that the hyperplane distances from the centers are very small, which implies that the corresponding biases are small as well. On the contrary, if all hidden units were centered on the center of the image, we would have the following problem. The hyperplanes of some hidden units must be positioned on the outer parts of the image. For this to happen, these units should develop large biases in respect to the weights. This would make their activations to have small variances. These small variances might need to be compensated by large output weights and biases, which would saturate the output units and in addition ill-condition the problems. One may wonder if the hidden biases are still necessary. Since the centers are individually set, it may seem at first that they are not. However, the centers are not trained through error backpropagation, and the hyperplanes do not necessarily pass over them. The biases role is to drive the hyperplanes to the correct location and thus pull the centers in the corresponding direction. The individual centering of the hidden units based on the samples’ positions is feasible, because we train only on samples with high errors and only the hidden units with high errors. By ignoring the small errors, we effectively position the center of each hidden unit near the center of mass of the high errors that it receives. However, this centering technique can still be used even if one chooses to train on all samples and all hidden units. Then, the statistics interval should be differentiated for each hidden unit and be recomputed for each sample relatively to the normalized absolute error that each hidden unit receives. A way to do it is to set the effective statistics interval for hidden unit j 2024 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS Figure 6: Hidden unit centers, standard deviations, hyperplanes, global and local training sets and a hidden unit’s output. The images were captured at the final stage of training, of the problem in Figure 1a with 64 hidden units. and sample s to: β |e j,s | |e j | where β is the global statistics interval, e j,s is the hidden unit’s backpropagated error for the sample and |e j | is the mean of the absolute backpropagated errors that the hidden unit receives, measured via an exponential trace. The denominator acts as a normalizer, which makes the hidden unit’s mobility to be independent of the average magnitude of the errors. Centering on other factors has been extensively investigated by Schraudolph (1998a,b). These techniques can provide further convergence acceleration, but we chose not to use them because of the additional computational overhead that they require. 3.4 A Hybrid Activation Function As it is shown in Section 5, the aforementioned techniques enable successful training on some difficult problems like those in Figures 1a and 1b. However, if the problem contains subproblems, or put in another way, if the problem generates more than one cluster of high error density, the centering mechanism does not manage to drive the hidden unit centers to the most suitable locations. The centers are attracted by the larger subproblem or get stuck in areas between the subproblems, as shown in Figure 7. 2025 C HARIATIS Figure 7: Model, training set, and inadequate centering We need a mechanism that can force a hidden unit to get out of balanced but suboptimal positions. It would be nice if this mechanism could also allow the centers to migrate to various points in the input space as the need arises. It has been found that both of these requirements are fulfilled by a new hybrid activation function. Sigmoid activations have the property that they produce hyperplanes that separate the input space globally. Our intention is to use a sigmoid like hidden activation function, because it can provide global separability, and at the same time, reduce the activation value towards zero on inputs which are not important to a hidden unit. The Gaussian function is commonly used within radial basis function (RBF) neural networks (Broomhead and Lowe, 1988). When this function is applied to the distance of a sample to the unit’s center, it produces a local response which is stronger near the center. We can then enclose the sigmoidal activation within a Gaussian envelope, by multiplying the activation with a value between 0 and 1, which is provided by applying the Gaussian function to the distance that is measured in the normalized input space. When the number of input dimensions is large, the distance metric that must be used is not an obvious choice. Table 1 contains the distance metrics that we have considered. The most suitable distance metric seems to depend on the distribution of the samples that train the hidden units. µ ∑ xi2 i=1 Euclidean 1 µ µ ∑ xi2 i=1 Euclidean Scaled µ ∑ |xi | i=1 Manhattan 1 µ µ ∑ |xi | i=1 Manhattan Scaled max |xi | Chebyshev Table 1: Various distance metrics that have been considered for the hybrid activation function. In particular, if the samples follow a uniform distribution over a hypercube, then the Euclidean distance has the disturbing property that the average distance grows larger as the number of input dimensions increases and consequently the corresponding average Gaussian response decreases towards zero. As suggested by Hegland and Pestov (1999), we can make the average distance to center independent of the input dimensions, by measuring it in the normalized input space and then dividing it by the square root of the input’s dimensionality. The same problem occurs for the Manhattan distance which has been claimed to be a better metric in high dimensions (Aggarwal et al., 2001). We can normalize this distance by dividing it by the input’s dimensionality. A problem that 2026 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS appears for both of the above rescaled distance metrics, is that for the samples that are near the axes the distances will be very much attenuated and the corresponding Gaussian responses will be close to one, something that will make the Gaussian envelopes ineffective. A more suitable metric for this type of distributions is the Chebyshev metric whose average magnitude is independent of the dimensions. However, for reasons analogous to those mentioned above, this metric is not the most suitable if the distribution of the samples is spherical. In that case, the Euclidean distance does not need any rescaling and is the most natural distance measure. We can obtain spherical distributions by adaptively whitening them. As Plumbley (1993) and Laheld and Cardoso (1994) independently proposed, the whitening matrix Z can be adaptively computed as: Zt+1 = Zt − λ zt zt T − I Zt where λ is the learning rate parameter, zt = Zt xt is the whitened vector and xt is the input vector. However, we would need too many additional parameters to do it individually for each subset of samples on which each hidden unit is trained. For the above reasons (and because of lack of a justified alternative), in the implementation of these techniques we typically use the Euclidean metric when the number of input dimensions is up to three and the Chebyshev metric in all other cases. We have also replaced the usual tanh (sigmoidal) and Gaussian (bell-like) functions, by similar functions which do not involve exponentials (Elliott, 1993). For each hidden unit j we first compute the net-input n j to the hidden unit (that is, the weighted distance of the sample to the hyperplane), as the inner product of normalized inputs and weights plus the bias: xi − m ji , s ji = z j · w j. z ji = nj We then compute the sample’s distance d j to the center of the unit which is measured in the normalized input space: dj = zj . Finally, we compute the activation h j as: nj , (1 + n j ) 1 , = bell(d j ) = (1 + d 2 ) j = a j b j. a j = Elliott(n j ) = bj hj Since d j is not a function of w j , we treat b j as a constant for the calculation of the activation derivative with respect to n j , which becomes: ∂h j = b j (1 − a j )2 . ∂n j 2027 C HARIATIS The hybrid activation function, which by definition may only be used for hidden units connected to the input layer, enables these units to acquire selective attention capabilities on the input space. Each hidden unit may have a global or local receptive field on each input dimension. The size of this dimensional receptive field depends on the standard deviation which is computed for the corresponding dimension. This activation makes balanced positions between subproblems to be unstable. As soon as the center is changed by a small amount, it will be attracted by the nearest subproblem. This is because the unit’s activation and the corresponding error will be increased for samples towards the nearest subproblem and decreased at the other direction. Hidden units can still be centered between subproblems but only if their movement at either direction causes a large error for samples at the opposite direction, that is, if they are absolutely necessary at their current position. Additionally, if a unit is centered near a subproblem that produces low errors and the unit is not necessary in that area, then it may migrate to other areas that still have high errors. This unit center migration has been observed in all experiments on complex problems. This may be due to the non-linear response of the bell function, and its long tails which keep the activation above zero for all input samples. Figure 8: Model, evaluation, training set, hidden unit centers and two hidden unit outputs showing the effect of the hybrid activation function. The images were captured at the final stage of training, of the problem in Figure 1d with 700 hidden units. In Figure 8 you can see a complex problem with 9 clusters of high errors. The hidden units place their centers on all clusters and are able to solve the problem. In the last two images, you can see the 2028 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS effect of the hybrid activation function which attenuates the activation at points far from the center in respect to the standard deviation on each dimension. One unit develops a near circular local receptive field and one other develops an elongated ellipsoidal receptive field. The later provides almost global separation in the vertical direction and becomes a useful discriminant for two of the subproblems. One may find similarities between this hybrid activation function and the Square-MLP architecture described by Flake (1998). The later, partially implements higher order neurons by duplicating the number of input units and setting the new input values equal to the squares of the original inputs. This architecture enables the hidden units to form local features of various shapes, but not the locally constrained sigmoid formed by our proposal. In contrast, the hybrid activation function does not need any additional parameters beyond those that are already used for centering and it has the additional benefit, which is realized by the local receptive fields in conjunction with the small biases and the symmetric sigmoid, that the hidden activations will have a mean close to zero. As discussed by Schraudolph (1998a,b) and LeCun et al. (1998), this is very beneficial for the output layer training. However, there is still room for improvement. As it was also observed by Flake (1998), the orientations of the receptive field ellipses are always at the direction of one of the input axes. This limitation is expected to hinder performance when training hidden units which have sloped hyperplanes. Figure 9 shows a complex problem at the middle of training. Units with sloped hyperplanes are trained on samples whose input values are highly correlated. This can slowdown learning by itself, but in addition, the standard deviations cannot get sufficiently small and as a result the receptive field cannot be sufficiently shrunk at the direction perpendicular to the hyperplane. As a result the hidden unit’s activation unnecessarily interferes with the activations of nearby units. Although it may be possible to address the correlation problem with a more sophisticated training method that uses second order gradient information, like Stochastic Meta Descent (Schraudolph, 1999, 2002), the orientations of the receptive fields will still be limited. In Section 6.2 we discuss possible directions for further research that may circumvent this limitation. Figure 9: Evaluation and global and local training sets during middle training for the problem in Figure 1b. It can be seen that a hidden unit with a sloped hyperplane is trained on samples with highly correlated input values. Samples that are separated by horizontal or vertical hyperplanes are easier to be learned. 2029 C HARIATIS 4. Further Speedups In this section we first describe an implementation technique that reduces the computational requirements of the error evaluation phase and then we give references to methods that have been proposed by other authors for the acceleration of the training phase. 4.1 Evaluation Speedup Two of the discussed techniques, training only for samples with high errors, and then, training only the hidden units with high error, make the error-evaluation phase to be the most processing demanding phase for the solution of a given problem. In addition, some other techniques, like board game learning through temporal difference methods, require many evaluations to be performed before each train. We can speedup evaluation by the following observation: For many problems, only part of the input is changed on successive samples. For example, for a backgammon program with 200 input units (with raw board data and not any additional features encoded), very few inputs will change on successive positions. Even on two dimensional problems such as images, we can arrange to train on samples selected by random changes on the X and Y dimensions alternatively. This process of only resampling one coordinate at a time is also known as “Gibbs sampling” and it nicely generalises to more than two coordinates (Geman and Geman, 1984). Thus, we can keep in memory all intermediate results from the evaluation, and recalculate only for the inputs that have changed. This implementation technique requires more storage, especially for high dimensional inputs. Fortunately, storage is not an issue on modern hardware. 4.2 Training Speedup Many authors have proposed methods for speeding-up online training by using second order gradient information in order to dynamically vary either the learning rate or the momentum (see LeCun et al., 1993; Leen and Orr, 1993; Murata et al., 1996; Harmon and Baird, 1996; Orr and Leen, 1996; Almeida et al., 1997; Amari, 1998; Schraudolph, 1998c, 1999, 2002; Graepel and Schraudolph, 2002). As it is shown in the next section, our techniques enable standard stochastic gradient descent with momentum to efficiently solve all the highly non-linear problems that have been investigated. However, the additional speed up that an accelerating algorithm can give is a nice thing to have. Moreover, these accelerating algorithms automatically reduce the learning rate when we are close to a solution (by sensing the oscillations in the error gradient) something that we should do through annealing if we wanted the best possible solution. We use the Incremental Delta-Delta (IDD) accelerating algorithm (Harmon and Baird, 1996), an incremental nonlinear extension to Jacobs’ (1988) Delta-Delta algorithm, because of its simplicity and relatively small processing requirements. IDD computes an individual learning rate λ for each weight w as: λ(t) = eξ(t) , ξ(t + 1) = ξ(t) + θ ∆w(t + 1) ∆w(t), λ(t) where θ is the meta-learning rate which we typically set to 0.1. 2030 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS 5. Experimental Results In order to measure the effectiveness of the described techniques on various classes of problems, we performed several experiments. Each experiment was replicated 10 times with different random initial weights using matched random seeds and the means and standard deviations of the results were plotted in the corresponding figures. For the experiments we used a single hidden layer, the cross entropy error function, the logistic or softmax activation function for the output units and the Elliott or hybrid activation function for the hidden units. Output to hidden layer weights and biases were initialized to zero. Hidden to input layer weights were initialized to random numbers from a normal distribution and then rescaled so that the incoming weights to each hidden unit had norm unity. Hidden unit biases were initialized to a uniform random number between zero and one. The curves in the figures are labelled with a combination of the following letters which indicate the techniques that were applied: B – Adjust weights using stochastic gradient descent with momentum 0.9 and fixed learning rate √ 0.1/ c where c is the number of incoming connections to the unit. A – Adjust weights using IDD with meta-learning rate 0.1 and initial learning rate √ 1/ c where c is as above. L – Use fixed cascaded inhibitory connections as described in Section 3.1. S – Skip weights adjustment for samples with low error as described in Section 2. U – Skip weights adjustment for hidden units with low error as described in Section 3.2. C – Use individual means and stdevs for each hidden to input connection as described in Section 3.3. H – Use the hybrid activation function as described in Section 3.4. For the ‘B’ training method we deliberately avoided an annealing schedule for the learning rate, since this would destroy the initial state invariance of our techniques. Instead, we used a fixed small learning rate which we compensated with a large momentum. For the ‘A’ method, we used a small meta-learning rate, to avoid instabilities due to the high non-linearities of the examined problems. It is important to note that for both training methods the learning parameters were fixed to the above values and not optimized to each individual problem. For the ‘C’ technique, the centers of the hidden units where initially set to the center of the input space and the standard deviations were set to one third of the distance between the extreme values of each dimension. When the technique was not used, a global preprocessing was applied which normalized the input samples to have zero mean and unit standard deviation. 5.1 Two Input Dimensions In this section we give experimental results for the class of problems that we have mainly examined, that is, problems in two input and one output dimensions, for which we have dense and noiseless training samples from the whole input space. In the figures, we measure the average classification error in respect to the stage of training. The classification error was averaged via an exponential trace with time scale 10−4 . 2031 C HARIATIS 5.1.1 C OMPARISON OF T ECHNIQUE C OMBINATIONS For these experiments we used the two-spirals problem shown in Figures 1a, 3, 4 and 6. We chose this problem as a non trivial representative of the class of problems that during early training generate a single cluster of high error density. The goal of this experiment is to measure the effectiveness of various technique combinations and then to measure how well the best technique combination scales with the size of the hidden layer. Figures 10 and 11 show the average classification error in respect to the number of evaluated samples and processing cycles respectively for 13 technique combinations. For these experiments we used 64 hidden units. The standard deviations were not plotted in order to keep the figures uncluttered. Figure 10 has also been split to Figures 12 and 13 in order to show the related error bars. Comparing the curves B vs. BL and BS vs. BLS on Figures 10 and 11, we can see that the fixed cascaded inhibitory connections reduce the asymptotic residual error by more than half. This also applies, but to a lesser degree, when we skip weight updates for hidden units with low errors (B vs. BU, BS vs. BSU). When used in combination, we can see a speed-up of convergence but the asymptotic error is only marginally further improved (BLU and BLSU). In Figure 11, it can be seen that skipping samples with low errors can speed-up convergence and reduce the asymptotic error as well (BLU vs. BLSU). This is a very intriguing result, in the sense that it implies that the system can learn faster and better by throwing away information. Both Figures 10 and 11 show the BLUCH curve to diverge. Considering the success of the BLSUCH curve, we can imply that skipping samples is necessary for the hybrid activation. However, the real problem, which was found out by viewing the dynamics of training, is that the centering mechanism does not work correctly when we train on all samples. A possible remedy may be to modify the statistics interval which is used for centering, as it is described at the end of Section 3.3. BLSUC vs. BLSU shows that centering further reduces the remaining asymptotic error to half and converges much faster as well. Comparing curve BLSUCH vs. BLSUC, we see that the hybrid activation function does better, but only marginally. This was expected since this problem has a single region of interest, so the ability of H to focus on multiple regions simultaneously is not exercised. This is the reason for the additional experiments in Section 5.1.2. BLSUCH and ALSUCH were the most successful technique combinations, with the later being a little faster. Nevertheless, it is very impressive that standard stochastic gradient descent with momentum can approach the best asymptotic error in less than a second, when using a modern 3.2 GHz processor. Figure 14 shows the average classification error in respect to the number of evaluated samples, for the ALSUCH technique combination and various hidden layer sizes. It can be seen that the asymptotic error is almost inversely proportional to the number of hidden units. This is a good indication that our techniques use the available resources efficiently. It is also interesting, that the convergence rates to the corresponding asymptotic errors are quite fast and about the same for all hidden layer sizes. 5.1.2 H YBRID VS . C ONVENTIONAL ACTIVATION For these experiments we used the two dimensional problem depicted in Figures 1c and 7. We chose this problem as a representative of the class of problems that during early training generate 2032 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS B BU BL BLU BLUC BLUCH ALSUCH 0,35 0,30 BS BSU BLS BLSU BLSUC BLSUCH 0,25 0,20 0,15 0,10 0,05 0,00 0 100000 200000 300000 400000 500000 600000 700000 800000 900000 1000000 Figure 10: Average classification error vs. number of evaluated samples for various technique combinations, while training the problem in Figure 1a with 64 hidden units. The standard deviations have been omitted for clarity. B BU BL BLU BLUC BLUCH ALSUCH 0,35 0,30 BS BSU BLS BLSU BLSUC BLSUCH 0,25 0,20 0,15 0,10 0,05 0,00 0 1 2 3 4 5 6 7 8 9 10 Figure 11: Average classification error vs. Intel IA32 CPU cycles in billions, for various technique combinations, while training the problem in Figure 1a with 64 hidden units. The horizontal scale also corresponds to seconds when run on a 1 GHz processor. The standard deviations have been omitted for clarity. 2033 C HARIATIS BS BLS BLSUC ALSUCH 0,35 BSU BLSU BLSUCH 0,30 0,25 0,20 0,15 0,10 0,05 0,00 0 100000 200000 300000 400000 500000 600000 700000 800000 900000 1000000 Figure 12: Part of Figure 10 showing error bars for technique combinations which employ S. B BL BLUC 0,35 BU BLU BLUCH 0,30 0,25 0,20 0,15 0,10 0,05 0,00 0 100000 200000 300000 400000 500000 600000 700000 800000 900000 1000000 Figure 13: Part of Figure 10 showing error bars for technique combinations which do not employ S. 2034 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS 32 48 64 96 128 256 0,20 0,15 0,10 0,05 0,00 0 100000 200000 300000 400000 500000 600000 700000 800000 900000 1000000 Figure 14: Average classification error vs. number of evaluated samples for various hidden layer sizes, while training the problem in Figure 1a with the ALSUCH technique combination. ALSUCH 0,04 ALSUC 0,03 0,02 0,01 0,00 0 300000 600000 900000 1200000 1500000 1800000 2100000 2400000 2700000 3000000 Figure 15: Average classification error vs. number of evaluated samples for the ALSUCH and ALSUC technique combinations, while training the problem in Figure 1c with 100 hidden units. The dashed lines show the minimum and maximum observed values. 2035 C HARIATIS small clusters of high error density of various sizes. For this kind of problems we typically obtain very small residuals for the classification error, although the problem may not have been learned. This is because we measure the error on the whole input space and for these problems most of the input space is trivial to be learned. The problem’s complexities are confined in very small areas. The dynamic training set evolution algorithm is able to locate these areas, but we need much more sample presentations, since most of the samples are not used for training. The goal of this experiment is to measure the effectiveness of the hybrid activation function at coping with the varying sizes of the subproblems. For these experiments we used 100 hidden units. Figure 15 shows that the ALSUCH technique, which employs the hybrid activation function, reduced the asymptotic error to half in respect to the ALSUC technique. As all of the visual inspections revealed, one of which is reproduced in Figure 16, the difference in the residual errors of the two curves is due to the insufficient approximation of the smaller subproblem by the ALSUC technique. Model ALSUCH ALSUC Figure 16: ALSUCH vs. ALSUC approximations for a problem with two sub-problems. 5.2 Higher Input and Output Dimensions In order to evaluate our techniques on a problem with higher input and output dimensions, we selected a standard benchmark, the Letter recognition database from the UCI Machine Learning Repository (Newman et al., 1998). This database consists of 20000 samples that use 16 integer attributes to classify the 26 letters of the English alphabet. This problem is characterized by a medium input dimensionality and a large output dimensionality. The later, makes it a very challenging problem for any classifier. This problem differs from those on which we have experimented so far, in that we do not have the whole input space at our disposal for training. We must train on a limited number of samples and then test the system’s generalization abilities on a separate test set. Although we have not taken any special measures to assist generalization, the experimental results indicate that our techniques have the inherent ability to generalize well, when given noiseless exemplars. An observation that applies to this problem is that the IDD accelerated training method could not do better than standard stochastic gradient descent with momentum. Thus, we report results using 2036 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS the BLSUCH technique combination which is computationally more efficient than the ALSUCH technique. For this experiment, which involves more than two output classes, we used the softmax activation function at the output layer. Table 2 contains previously published results showing the classification accuracy of various classifiers. The most successful of them were the AdaBoosted versions of the C4.5 decision-tree algorithm and of a feed forward neural network with two hidden layers. Both classifier ensembles required quite a lot of machines in order to achieve that high accuracy. Classifier Naive Bayesian classifier AdaBoost on Naive Bayesian classifier Holland-style adaptive classifier C4.5 AdaBoost on C4.5 (100 machines) AdaBoost on C4.5 (1000 machines) CART AdaBoost on CART (50 machines) 16-70-50-26 MLP (500 online epochs) AdaBoost on 16-70-50-26 MLP (20 machines) AdaBoost on 16-70-50-26 MLP (100 machines) Nearest Neighbor Test Error % 25,3 24,1 17,3 13,8 3,3 3,1 12,4 3,4 6,2 2,0 1,5 4,3 Reference Ting and Zheng (1999) Ting and Zheng (1999) Frey and Slate (1991) Freund and Schapire (1996) Freund and Schapire (1996) Schapire et al. (1997) Breiman (1996) Breiman (1996) Schwenk and Bengio (1998) Schwenk and Bengio (1998) Schwenk and Bengio (2000) Fogarty (1992) Table 2: A compilation of previously reported best error rates on the test set for the UCI Letters Recognition Database. Figure 17 shows the average error reduction in respect to the number of online epochs, for the BLSUCH technique combination and various hidden layer sizes. As suggested in the database’s documentation, we used the first 16000 samples for training and for measuring the training accuracy and the rest 4000 samples to measure the predictive accuracy. The solid and dashed curves show the test and training set errors respectively. Similarly to ensemble methods, we can observe two interesting phenomena which both seem to contradict the Occam’s razor principle. The first observation is that the test error stabilizes or continues to slightly decrease even after the training error has been zeroed. What is really happening is that the RMS error for the training set (which is related to the confidence of classification) continues to decrease even after the classification error has been zeroed, something that is also beneficiary for the test set’s classification error. The second observation is that increasing the network’s capacity does not lead to over fitting. Although the training set error can be zeroed with just 125 hidden units, increasing the number of hidden units reduces the residual test error as well. We attribute this phenomenon to the conjecture that the hidden units’ differentiation results in a smoother approximation (as suggested by Figure 5 and the related discussion). Comparing our results with those in Table 2, we can also observe the following: The 16-125-26 MLP (5401 weights) reached a 4.6% misclassification error on average, which is 26% better than the 6.2% of the 16-70-50-26 MLP (6066 weights), despite the fact that it had fewer weights, a simpler 2037 C HARIATIS 125 T RAIN 125 T EST 250 T RAIN 250 T EST 500 T RAIN 500 T EST 1000 T RAIN TEST ERROR % UNITS MIN AVG at end 125 4.0 4.6 250 2.8 3.2 500 2.3 2.6 1000 2.1 2.4 0,10 1000 T EST 0,05 0,00 0 10 20 30 40 50 60 70 80 90 100 Figure 17: Average error reduction vs. number of online epochs for various hidden layer sizes, while training on the UCI Letters Recognition Database with the BLSUCH technique combination. The solid and dashed curves show the test and training set errors respectively. The standard deviations for the training set errors have been omitted for clarity. The embedded table contains the minimum observed errors across all trials and epochs, and the average errors across all trials at epoch 100. architecture with one hidden layer only and it was trained for a far less number of online epochs. It is indicative that the asymptotic residual classification error on the test set was reached in about 30 online epochs. The 16-1000-26 MLP (43026 weights) reached a 2.4% misclassification error on average, which is the third best published result following the AdaBoosted 16-70-50-26 MLPs with 20 and 100 machines (121320 and 606600 weights respectively). The lowest observed classification error was 2.1% and was reached in one of the 10 runs at the 80th epoch. It must be stressed that the above results were obtained without any optimization of the learning rate, without a learning rate annealing schedule and within a by far shorter training time. All MLPs with 250 hidden units and above, gave results which put them at the top of the list of non-ensemble techniques and they even outperformed Adaboost on C4.5 with 100 machines. Similarly to Figure 14, we also see that the convergence rates to the corresponding asymptotic errors on the test set are quite fast and about the same for all hidden layer sizes. 6. Discussion and Future Research We have presented global and local selective attention techniques that can help neural network training to concentrate on the difficult parts of complex non-linear problems. A new hybrid activation function has also been presented that enables the hidden units to acquire individual receptive fields 2038 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS in the input space. These individual receptive fields may be global or local depending on the problem’s local complexities. The success of the new activation function is due to the fact that it depends on two distances. The first is the weighted distance of a sample to the hidden unit’s hyperplane. The second is the distance to the hidden unit’s center. We need both distances and neither of them is sufficient. The first helps us discriminate and the second helps us localize. The dynamic training set evolution algorithm locates the sub-areas of the input space where the problem resides. The fixed cascaded inhibitory connections and the selective training of a subset of the hidden units on each sample, force the hidden units to get differentiated and attack different subproblems. The individual centering of the hidden units at different points in the input space, adaptively conditions the network to the problem’s local structures and enables each hidden unit to solve a well-conditioned subproblem. In coordination with the above, the hidden units’ limited receptive fields allow training to follow a divide and conquer paradigm where each hidden unit only solves a local subproblem. The solutions to the subproblems are then combined by the output layer to give a solution to the original problem. In the reported experiments we initialized the hidden weights and biases so that the hidden hyperplanes would cover the whole input space at random positions and orientations. The initial norm of the weights was also adjusted so that the net-input to each hidden unit would fall in the transition between the linear and non-linear range of the activation function. These specific initializations were necessary for standard backpropagation. On the contrary, we have found that the combined techniques are insensitive to the initial weights and biases, as long as their values are small. We have repeated the experiments with hidden biases set to zero and hidden weight norms set to 10 −3 and the results where equivalent to those reported in Section 5. However, the choice of the best initial learning rate is still problem specific. An additional and important characteristic of these techniques is that training of the hidden layer does not depend solely on gradient information. Gradient based techniques can only perform local optimization by locating a local minimum of the error function when the system is already at the basin of attraction of that minimum. Stochastic training has a potential of escaping from a shallow basin, but only when the basin is not very wide. Once there, the system cannot escape towards a different basin with a lower minimum. On the contrary, in our model some of the hidden layer’s free parameters (the weights) are trained through gradient descent on the error, whereas some other (the means and standard deviations) are “trained” from the statistical properties of the back-propagated errors. Each hidden unit places its center near the center of mass of the error that it receives and limits its visibility only to the area of the input space where it produces a significant error. This model makes the hidden error landscape to constantly change. We conjecture that during training, paths connecting the various error basins are continuously emerging and vanishing. As a result the system can explore much more of the solution space. It is indicative that in all the reported experiments, all trials converged to a solution with more or less the same residual error irrespectively of the initial network state. The combination of the presented techniques enables very fast training on complex classification problems with embedded subproblems. By focusing on the problem’s details and efficiently utilizing the available resources, they make feasible the solution of very difficult problems (like the one in Figure 1e), provided that the adequate number of hidden units has been used. Although other machine learning techniques can do the same, to our knowledge this is the first report that this can be done using ordinary feed forward neural networks and backpropagation, in an online, adaptive 2039 C HARIATIS and memory-less scenario, where the input exemplars are unknown before training and discarded after being used. In the following we discuss some areas that deserve further investigation. 6.1 Generalization and Regression For the classes of problems that were investigated, we had noiseless exemplars and the whole input space at our disposal for training, so there was no danger of overfitting. Thus, we did not use any mechanism to assist generalization. This does not mean of course that the network just stored the input output mapping, as a lookup table would do. By putting constraints on the positions and orientations of the hidden unit hyperplanes and by limiting their receptive fields, we reduced the system’s available degrees of freedom, and the network arranged its resources in a way to achieve the best possible input-output mapping approximation. The experiments on the Letter Recognition Database showed remarkable generalization capabilities. However, when we train on noisy samples or when the number of training samples is small in respect to the size and complexity of the input space, we have the danger of overfitting. It remains to be examined how the described techniques are affected by methods that avoid overfitting, such as, training with jitter, error regularization, target smoothing and sigmoid gain attenuation (Reed et al., 1995). This consideration also applies to regression problems which usually require smoother approximations. Although early experiments give evidence that the presented techniques can be applied to regression problems as well, we feel that some smoothing technique must be included in the training framework. 6.2 Receptive Fields Limited Orientations As it was noted in Section 3.4, the orientations of the receptive field ellipses are limited to have the direction of one of the input axes. This hinders training performance by not allowing the receptive fields to be adequately shrunk at the direction perpendicular to the hyperplane. In addition, hidden units with sloped hyperplanes are trained on highly correlated input values. These problems are expected to be exaggerated in high dimensional input spaces. We would cure both of these problems simultaneously, if we could individually transform the input for each hidden unit through adaptive whitening, or, if we could present to each hidden unit a rotated view of the input space, such that, one of the axes to be perpendicular to the hyperplane and the rest to be parallel to the hyperplane. Unfortunately, both of the above transformations would require too many additional parameters. An approximation (for 2 dimensional problems) that we are currently investigating upon is the following: For each input vector we compute K vectors rotated around the center of the input space with successive angle increments equal to π/(2K). Our purpose is to obtain uniform rotations between 0 and π/4. Every a few hundred training steps, we reassign to each hidden unit the most appropriate input representation and adjust the affected parameters (weights, means and stdevs). The results are promising. 6.3 Dynamic Cascaded Inhibitory Connections Regarding the fixed cascaded inhibitory connections, it must be examined whether it is better to make the strength of the connections, dynamic. Minus one is OK when the weights are small. How2040 V ERY FAST O NLINE L EARNING OF H IGHLY N ON L INEAR P ROBLEMS ever as the weights get larger, the inhibitory connections get less and less effective to differentiate the hidden units. We can try to make them relative to each hidden unit’s average absolute net-input or alternatively to make them trainable. It has been observed that increasing the strength of these connections enables the hidden units to generate more curved discriminant functions, which is very beneficiary for some problems. 6.4 Miscellaneous More experiments need to be done, in order to evaluate the effectiveness of the hybrid activation function on highly non-linear problems in many dimensions. High dimensional input spaces have a multitude of disturbing properties in regard to distance and density metrics, which may affect the hybrid activation in yet unknown ways. Last, we must devise a training mechanism, that will be invariant to the initial learning rate and that will vary automatically the number of hidden units as each problem requires. Acknowledgments I would like to thank all participants in my threads in usenet comp.ai.neural-nets, for their fruitful comments on early presentations of the subjects in this report. Special thanks to Aleks Jakulin for his support and ideas on further research that can make these results even better and to Greg Heath for bringing to my attention the perturbated forms for the calculation of sliding window statistics. I also thank the area editor L´ on Bottou and the anonymous reviewers for their valuable comments e and for helping me to bring this report in shape for publication. Appendix A. Notational Conventions The following list contains the meanings of the symbols that have been used in this report. Symbols with subscripts are used either as scalars or as vectors and matrices when the subscripts are omitted. For example, w ji is a single weight, w j is a weight vector and W is a weight matrix. α – A constant that determines the time scale of the exponential trace of the average training-set error within the dynamic training set evolution algorithm. β – A constant that determines the time scale of the exponential trace of the input means and standard deviations. δ – An accumulator for the efficient implementation of the fixed cascaded inhibitory connections. η – The number of hidden units. µ – The number of input units. f – The hidden units’ squashing function. i – Index enumerating the input units. j – Index enumerating the hidden units. k – Index enumerating the output units. 2041 C HARIATIS a j – The hidden unit’s activation computed from the sample’s weighted distance to the hidden unit’s hyperplane. b j – The hidden unit’s activation attenuation computed from the sample’s distance to the hidden unit’s center. d j – The sample’s distance to the hidden unit’s center. e j – The hidden unit’s accumulated back propagated errors. g j – The hidden unit’s error signal f (n j ) e j . h j – The hidden unit’s activation. m ji – The mean of the values received by hidden unit j from input unit i. n j – The net-input to the hidden unit. q ji – The mean of the squared values received by hidden unit j from input unit i. rk – The error of output unit k. s ji – The standard deviation of the values received by hidden unit j from input unit i. u jk – The weight of the connection from hidden unit j to output unit k. v ji – The variance of the values received by hidden unit j from input unit i. w ji – The weight of the connection from hidden unit j to input unit i. xi – The value of input unit i. z ji – The normalized input value received by hidden unit j from input unit i. 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