## Archive for the ‘**Machine Learning**’ Category

## Random Search for Optimal Parameters

Practices of manual search, grid search, or the combination of both have been successfully employed in the machine learning to optimize hyper-parameters. However, in the arena of deep learning, both approaches might become impractical. For instance, the computing cost of grid search for hyper-parameters in a multi-layer deep neural network (DNN) could be prohibitively high.

In light of aforementioned hurdles, Bergstra and Bengio proposed a novel idea of random search in the paper http://www.jmlr.org/papers/volume13/bergstra12a/bergstra12a.pdf. In their study, it was found that random search is more efficient than grid search for the hyper-parameter optimization in terms of computing costs.

In the example below, it is shown that both grid search and random search have reached similar results in the SVM parameter optimization based on cross-validations.

import pandas as pd import numpy as np from sklearn import preprocessing from sklearn.model_selection import GridSearchCV, RandomizedSearchCV from sklearn.svm import SVC as svc from sklearn.metrics import make_scorer, roc_auc_score from scipy import stats # DATA PREPARATION df = pd.read_csv("credit_count.txt") y = df[df.CARDHLDR == 1].DEFAULT.values x = preprocessing.scale(df[df.CARDHLDR == 1].ix[:, 2:12], axis = 0) # DEFINE MODEL AND PERFORMANCE MEASURE mdl = svc(probability = True, random_state = 1) auc = make_scorer(roc_auc_score) # GRID SEARCH FOR 20 COMBINATIONS OF PARAMETERS grid_list = {"C": np.arange(2, 10, 2), "gamma": np.arange(0.1, 1, 0.2)} grid_search = GridSearchCV(mdl, param_grid = grid_list, n_jobs = 4, cv = 3, scoring = auc) grid_search.fit(x, y) grid_search.cv_results_ # RANDOM SEARCH FOR 20 COMBINATIONS OF PARAMETERS rand_list = {"C": stats.uniform(2, 10), "gamma": stats.uniform(0.1, 1)} rand_search = RandomizedSearchCV(mdl, param_distributions = rand_list, n_iter = 20, n_jobs = 4, cv = 3, random_state = 2017, scoring = auc) rand_search.fit(x, y) rand_search.cv_results_

## A Simple Convolutional Neural Network for The Binary Outcome

Since CNN(Convolutional Neural Networks) have achieved a tremendous success in various challenging applications, e.g. image or digit recognitions, one might wonder how to employ CNNs in classification problems with binary outcomes.

Below is an example showing how to use a simple 1D convolutional neural network to predict credit card defaults.

### LOAD PACKAGES from numpy.random import seed from pandas import read_csv, DataFrame from sklearn.preprocessing import minmax_scale from keras.layers.convolutional import Conv1D, MaxPooling1D from keras.optimizers import SGD from keras.models import Sequential from keras.layers import Dense, Flatten ### PREPARE THE DATA df = read_csv("credit_count.txt") Y = df[df.CARDHLDR == 1].DEFAULT X = minmax_scale(df[df.CARDHLDR == 1].ix[:, 2:12], axis = 0) y_train = Y.values x_train = X.reshape(X.shape[0], X.shape[1], 1) ### FIT A 1D CONVOLUTIONAL NEURAL NETWORK seed(2017) conv = Sequential() conv.add(Conv1D(20, 4, input_shape = x_train.shape[1:3], activation = 'relu')) conv.add(MaxPooling1D(2)) conv.add(Flatten()) conv.add(Dense(1, activation = 'sigmoid')) sgd = SGD(lr = 0.1, momentum = 0.9, decay = 0, nesterov = False) conv.compile(loss = 'binary_crossentropy', optimizer = sgd, metrics = ['accuracy']) conv.fit(x_train, y_train, batch_size = 500, epochs = 100, verbose = 0)

Considering that 1D is the special case of 2D, we can also solve the same problem with a 2D convolutional neural network by changing the input shape, as shown below.

from numpy.random import seed from pandas import read_csv, DataFrame from sklearn.preprocessing import minmax_scale from keras_diagram import ascii from keras.layers.convolutional import Conv2D, MaxPooling2D from keras.optimizers import SGD from keras.models import Sequential from keras.layers import Dense, Flatten df = read_csv("credit_count.txt") Y = df[df.CARDHLDR == 1].DEFAULT X = minmax_scale(df[df.CARDHLDR == 1].ix[:, 2:12], axis = 0) y_train = Y.values x_train = X.reshape(X.shape[0], 1, X.shape[1], 1) seed(2017) conv = Sequential() conv.add(Conv2D(20, (1, 4), input_shape = x_train.shape[1:4], activation = 'relu')) conv.add(MaxPooling2D((1, 2))) conv.add(Flatten()) conv.add(Dense(1, activation = 'sigmoid')) sgd = SGD(lr = 0.1, momentum = 0.9, decay = 0, nesterov = False) conv.compile(loss = 'binary_crossentropy', optimizer = sgd, metrics = ['accuracy']) conv.fit(x_train, y_train, batch_size = 500, epochs = 100, verbose = 0)

## Autoencoder for Dimensionality Reduction

We often use ICA or PCA to extract features from the high-dimensional data. The autoencoder is another interesting algorithm to achieve the same purpose in the context of Deep Learning.

with the purpose of learning a function to approximate the input data itself such that F(X) = X, an autoencoder consists of two parts, namely encoder and decoder. While the encoder aims to compress the original input data into a low-dimensional representation, the decoder tries to reconstruct the original input data based on the low-dimension representation generated by the encoder. As a result, the autoencoder has been widely used to remove the data noise as well to reduce the data dimension.

First of all, we will show the basic structure of an autoencoder with 1-layer encoder and 1-layer decoder, as below. In the example, we will compress the input data with 10 columns into a compressed on with 3 columns.

from pandas import read_csv, DataFrame from numpy.random import seed from sklearn.preprocessing import minmax_scale from sklearn.model_selection import train_test_split from keras.layers import Input, Dense from keras.models import Model df = read_csv("credit_count.txt") Y = df[df.CARDHLDR == 1].DEFAULTS X = df[df.CARDHLDR == 1].ix[:, 2:12] # SCALE EACH FEATURE INTO [0, 1] RANGE sX = minmax_scale(X, axis = 0) ncol = sX.shape[1] X_train, X_test, Y_train, Y_test = train_test_split(sX, Y, train_size = 0.5, random_state = seed(2017)) ### AN EXAMPLE OF SIMPLE AUTOENCODER ### # InputLayer (None, 10) # Dense (None, 5) # Dense (None, 10) input_dim = Input(shape = (ncol, )) # DEFINE THE DIMENSION OF ENCODER ASSUMED 3 encoding_dim = 3 # DEFINE THE ENCODER LAYER encoded = Dense(encoding_dim, activation = 'relu')(input_dim) # DEFINE THE DECODER LAYER decoded = Dense(ncol, activation = 'sigmoid')(encoded) # COMBINE ENCODER AND DECODER INTO AN AUTOENCODER MODEL autoencoder = Model(input = input_dim, output = decoded) # CONFIGURE AND TRAIN THE AUTOENCODER autoencoder.compile(optimizer = 'adadelta', loss = 'binary_crossentropy') autoencoder.fit(X_train, X_train, nb_epoch = 50, batch_size = 100, shuffle = True, validation_data = (X_test, X_test)) # THE ENCODER TO EXTRACT THE REDUCED DIMENSION FROM THE ABOVE AUTOENCODER encoder = Model(input = input_dim, output = encoded) encoded_input = Input(shape = (encoding_dim, )) encoded_out = encoder.predict(X_test) encoded_out[0:2] #array([[ 0. , 1.26510417, 1.62803197], # [ 2.32508397, 0.99735016, 2.06461048]], dtype=float32)

In the next example, we will relax the constraint of layers and employ a stack of layers to achievement the same purpose as above.

### AN EXAMPLE OF DEEP AUTOENCODER WITH MULTIPLE LAYERS # InputLayer (None, 10) # Dense (None, 20) # Dense (None, 10) # Dense (None, 5) # Dense (None, 3) # Dense (None, 5) # Dense (None, 10) # Dense (None, 20) # Dense (None, 10) input_dim = Input(shape = (ncol, )) # DEFINE THE DIMENSION OF ENCODER ASSUMED 3 encoding_dim = 3 # DEFINE THE ENCODER LAYERS encoded1 = Dense(20, activation = 'relu')(input_dim) encoded2 = Dense(10, activation = 'relu')(encoded1) encoded3 = Dense(5, activation = 'relu')(encoded2) encoded4 = Dense(encoding_dim, activation = 'relu')(encoded3) # DEFINE THE DECODER LAYERS decoded1 = Dense(5, activation = 'relu')(encoded4) decoded2 = Dense(10, activation = 'relu')(decoded1) decoded3 = Dense(20, activation = 'relu')(decoded2) decoded4 = Dense(ncol, activation = 'sigmoid')(decoded3) # COMBINE ENCODER AND DECODER INTO AN AUTOENCODER MODEL autoencoder = Model(input = input_dim, output = decoded4) # CONFIGURE AND TRAIN THE AUTOENCODER autoencoder.compile(optimizer = 'adadelta', loss = 'binary_crossentropy') autoencoder.fit(X_train, X_train, nb_epoch = 100, batch_size = 100, shuffle = True, validation_data = (X_test, X_test)) # THE ENCODER TO EXTRACT THE REDUCED DIMENSION FROM THE ABOVE AUTOENCODER encoder = Model(input = input_dim, output = encoded4) encoded_input = Input(shape = (encoding_dim, )) encoded_out = encoder.predict(X_test) encoded_out[0:2] #array([[ 3.74947715, 0. , 3.22947764], # [ 3.93903661, 0.17448257, 1.86618853]], dtype=float32)

## An Example of Merge Layer in Keras

The power of a DNN does not only come from its depth but also come from its flexibility of accommodating complex network structures. For instance, the DNN shown below consists of two branches, the left with 4 inputs and the right with 6 inputs. In addition, the right branch shows a more complicated structure than the left.

InputLayer (None, 6) Dense (None, 6) BatchNormalization (None, 6) Dense (None, 6) InputLayer (None, 4) BatchNormalization (None, 6) Dense (None, 4) Dense (None, 6) BatchNormalization (None, 4) BatchNormalization (None, 6) \____________________________________/ | Merge (None, 10) Dense (None, 1)

To create a DNN as the above, both left and right branches are defined separately with corresponding inputs and layers. In the line 29, both branches would be combined with a MERGE layer. There are multiple benefits of such merged DNNs. For instance, the DNN has the flexibility to handle various inputs differently. In addition, new features can be added conveniently without messing around with the existing network structure.

from pandas import read_csv, DataFrame from numpy.random import seed from sklearn.preprocessing import scale from keras.models import Sequential from keras.constraints import maxnorm from keras.optimizers import SGD from keras.layers import Dense, Merge from keras.layers.normalization import BatchNormalization from keras_diagram import ascii df = read_csv("credit_count.txt") Y = df[df.CARDHLDR == 1].DEFAULTS X1 = scale(df[df.CARDHLDR == 1][["MAJORDRG", "MINORDRG", "OWNRENT", "SELFEMPL"]]) X2 = scale(df[df.CARDHLDR == 1][["AGE", "ACADMOS", "ADEPCNT", "INCPER", "EXP_INC", "INCOME"]]) branch1 = Sequential() branch1.add(Dense(X1.shape[1], input_shape = (X1.shape[1],), init = 'normal', activation = 'relu')) branch1.add(BatchNormalization()) branch2 = Sequential() branch2.add(Dense(X2.shape[1], input_shape = (X2.shape[1],), init = 'normal', activation = 'relu')) branch2.add(BatchNormalization()) branch2.add(Dense(X2.shape[1], init = 'normal', activation = 'relu', W_constraint = maxnorm(5))) branch2.add(BatchNormalization()) branch2.add(Dense(X2.shape[1], init = 'normal', activation = 'relu', W_constraint = maxnorm(5))) branch2.add(BatchNormalization()) model = Sequential() model.add(Merge([branch1, branch2], mode = 'concat')) model.add(Dense(1, init = 'normal', activation = 'sigmoid')) sgd = SGD(lr = 0.1, momentum = 0.9, decay = 0, nesterov = False) model.compile(loss = 'binary_crossentropy', optimizer = sgd, metrics = ['accuracy']) seed(2017) model.fit([X1, X2], Y.values, batch_size = 2000, nb_epoch = 100, verbose = 1)

## Dropout Regularization in Deep Neural Networks

The deep neural network (DNN) is a very powerful neural work with multiple hidden layers and is able to capture the highly complex relationship between the response and predictors. However, it is prone to the over-fitting due to a large number of parameters that makes the regularization crucial for DNNs. In the paper (https://www.cs.toronto.edu/~hinton/absps/JMLRdropout.pdf), an interesting regularization approach, e.g. dropout, was proposed with a simple and elegant idea. Basically, it suppresses the complexity of DNNs by randomly dropping units in both input and hidden layers.

Below is an example showing how to tune the hyper-parameter of dropout rates with Keras library in Python. Because of the long computing time required by the dropout, the parallelism is used to speed up the process.

from pandas import read_csv, DataFrame from numpy.random import seed from sklearn.preprocessing import scale from sklearn.model_selection import train_test_split from sklearn.metrics import roc_auc_score from keras.models import Sequential from keras.constraints import maxnorm from keras.optimizers import SGD from keras.layers import Dense, Dropout from multiprocessing import Pool, cpu_count from itertools import product from parmap import starmap df = read_csv("credit_count.txt") Y = df[df.CARDHLDR == 1].DEFAULT X = df[df.CARDHLDR == 1][['AGE', 'ADEPCNT', 'MAJORDRG', 'MINORDRG', 'INCOME', 'OWNRENT', 'SELFEMPL']] sX = scale(X) ncol = sX.shape[1] x_train, x_test, y_train, y_test = train_test_split(sX, Y, train_size = 0.5, random_state = seed(2017)) def tune_dropout(rate1, rate2): net = Sequential() ## DROPOUT AT THE INPUT LAYER net.add(Dropout(rate1, input_shape = (ncol,))) ## DROPOUT AT THE 1ST HIDDEN LAYER net.add(Dense(ncol, init = 'normal', activation = 'relu', W_constraint = maxnorm(4))) net.add(Dropout(rate2)) ## DROPOUT AT THE 2ND HIDDER LAYER net.add(Dense(ncol, init = 'normal', activation = 'relu', W_constraint = maxnorm(4))) net.add(Dropout(rate2)) net.add(Dense(1, init = 'normal', activation = 'sigmoid')) sgd = SGD(lr = 0.1, momentum = 0.9, decay = 0, nesterov = False) net.compile(loss='binary_crossentropy', optimizer = sgd, metrics = ['accuracy']) net.fit(x_train, y_train, batch_size = 200, nb_epoch = 50, verbose = 0) print rate1, rate2, "{:6.4f}".format(roc_auc_score(y_test, net.predict(x_test))) input_dp = [0.1, 0.2, 0.3] hidden_dp = [0.2, 0.3, 0.4, 0.5] parms = [i for i in product(input_dp, hidden_dp)] seed(2017) starmap(tune_dropout, parms, pool = Pool(processes = cpu_count()))

As shown in the output below, the optimal dropout rate appears to be 0.2 incidentally for both input and hidden layers.

0.1 0.2 0.6354 0.1 0.4 0.6336 0.1 0.3 0.6389 0.1 0.5 0.6378 0.2 0.2 0.6419 0.2 0.4 0.6385 0.2 0.3 0.6366 0.2 0.5 0.6359 0.3 0.4 0.6313 0.3 0.2 0.6350 0.3 0.3 0.6346 0.3 0.5 0.6343

## SAS Macro Calculating Mutual Information

In statistics, various correlation functions, either Spearman or Pearson, have been used to measure the dependence between two data vectors under the linear or monotonic assumption. Mutual Information (MI) is an alternative widely used in Information Theory and is considered a more general measurement of the dependence between two vectors. More specifically, MI quantifies how much information two vectors, regardless of their actual values, might share based on their joint and marginal probability distribution functions.

Below is a sas macro implementing MI and Normalized MI by mimicking functions in Python, e.g. mutual_info_score() and normalized_mutual_info_score(). Although MI is used to evaluate the cluster analysis performance in sklearn package, it can also be used as an useful tool for Feature Selection in the context of Machine Learning and Statistical Modeling.

%macro mutual(data = , x = , y = ); ***********************************************************; * SAS MACRO CALCULATING MUTUAL INFORMATION AND ITS *; * NORMALIZED VARIANT BETWEEN TWO VECTORS BY MIMICKING *; * SKLEARN.METRICS.NORMALIZED_MUTUAL_INFO_SCORE() *; * SKLEARN.METRICS.MUTUAL_INFO_SCORE() IN PYTHON *; * ======================================================= *; * INPUT PAREMETERS: *; * DATA : INPUT SAS DATA TABLE *; * X : FIRST INPUT VECTOR *; * Y : SECOND INPUT VECTOR *; * ======================================================= *; * AUTHOR: WENSUI.LIU@53.COM *; ***********************************************************; data _1; set &data; where &x ~= . and &y ~= .; _id = _n_; run; proc sql; create table _2 as select _id, &x, &y, 1 / (select count(*) from _1) as _p_xy from _1; create table _3 as select _id, &x as _x, sum(_p_xy) as _p_x, sum(_p_xy) * log(sum(_p_xy)) / count(*) as _h_x from _2 group by &x; create table _4 as select _id, &y as _y, sum(_p_xy) as _p_y, sum(_p_xy) * log(sum(_p_xy)) / count(*) as _h_y from _2 group by &y; create table _5 as select a.*, b._p_x, b._h_x, c._p_y, c._h_y, a._p_xy * log(a._p_xy / (b._p_x * c._p_y)) as mutual from _2 as a, _3 as b, _4 as c where a._id = b._id and a._id = c._id; select sum(mutual) as MI format = 12.8, case when sum(mutual) = 0 then 0 else sum(mutual) / (sum(_h_x) * sum(_h_y)) ** 0.5 end as NMI format = 12.8 from _5; quit; %mend mutual;

## Python Prototype of Grid Search for SVM Parameters

from itertools import product from pandas import read_table, DataFrame from sklearn.cross_validation import KFold as kfold from sklearn.svm import SVC as svc from sklearn.metrics import roc_auc_score as auc df = read_table('credit_count.txt', sep = ',') Y = df[df.CARDHLDR == 1].DEFAULT X = df[df.CARDHLDR == 1][['AGE', 'ADEPCNT', 'MAJORDRG', 'MINORDRG', 'INCOME', 'OWNRENT', 'SELFEMPL']] c = [1, 10] g = [0.01, 0.001] parms = [i for i in product(c, g)] kf = [i for i in kfold(Y.count(), n_folds = 3, shuffle = True, random_state = 0)] final = DataFrame() for i in parms: result = DataFrame() mdl = svc(C = i[0], gamma = i[1], probability = True, random_state = 0) for j in kf: X1 = X.iloc[j[0]] Y1 = Y.iloc[j[0]] X2 = X.iloc[j[1]] Y2 = Y.iloc[j[1]] mdl.fit(X1, Y1) pred = mdl.predict_proba(X2)[:, 1] out = DataFrame({'pred': pred, 'y': Y2}) result = result.append(out) perf = DataFrame({'Cost': i[0], 'Gamma': i[1], 'AUC': [auc(result.y, result.pred)]}) final = final.append(perf)