=Paper= {{Paper |id=Vol-2660/ialatecml_paper3 |storemode=property |title=Learning Active Learning at the Crossroads? Evaluation and Discussion |pdfUrl=https://ceur-ws.org/Vol-2660/ialatecml_paper3.pdf |volume=Vol-2660 |authors=Louis Desreumaux,Vincent Lemaire |dblpUrl=https://dblp.org/rec/conf/pkdd/Desreumaux020 }} ==Learning Active Learning at the Crossroads? Evaluation and Discussion== https://ceur-ws.org/Vol-2660/ialatecml_paper3.pdf
      Learning active learning at the crossroads?
              evaluation and discussion

                             L. Desreumaux1 , V. Lemaire2
                                 1
                                   SAP Labs, Paris, France
                             2
                                 Orange Labs, Lannion, France



        Abstract. Active learning aims to reduce annotation cost by predict-
        ing which samples are useful for a human expert to label. Although this
        field is quite old, several important challenges to using active learning
        in real-world settings still remain unsolved. In particular, most selec-
        tion strategies are hand-designed, and it has become clear that there is
        no best active learning strategy that consistently outperforms all oth-
        ers in all applications. This has motivated research into meta-learning
        algorithms for “learning how to actively learn”. In this paper, we com-
        pare this kind of approach with the association of a Random Forest with
        the margin sampling strategy, reported in recent comparative studies as
        a very competitive heuristic. To this end, we present the results of a
        benchmark performed on 20 datasets that compares a strategy learned
        using a recent meta-learning algorithm with margin sampling. We also
        present some lessons learned and open future perspectives.


1     Introduction

Modern supervised learning methods3 are known to require large amounts of
training examples to reach their full potential. Since these examples are mainly
obtained through human experts who manually label samples, the labelling pro-
cess may have a high cost. Active learning (AL) is a field that includes all the
selection strategies that allow to iteratively build the training set of a model in
interaction with a human expert, also called oracle. The aim is to select the most
informative examples to minimize the labelling cost.
    In this article, we consider the selective sampling framework, in which the
strategies manipulate a set of examples D = L ∪ U of constant size, where
L = {(xi , yi )}li=1 is the set of labelled examples and U = {xi }ni=l+1 is the set of
unlabelled examples. In this framework, active learning is an iterative process
that continues until a labelling budget is exhausted or a pre-defined perfor-
mance threshold is reached. Each iteration begins with the selection of the most
informative example x? ∈ U. This selection is generally based on information
collected during previous iterations (predictions of a classifier, density measures,
etc.). The example x? is then submitted to the oracle that returns the corre-
sponding class y ? , and the pair (x? , y ? ) is added to L. The new learning set is
3
    In this article, we limit ourselves to binary classification problems.

    © 2020 for this paper by its authors. Use permitted under CC BY 4.0.
2        L. Desreumaux
       Learning          and V. Lemaire
                Active Learning at the Crossroads? Evaluation and Discussion            39

then used to improve the model and the new predictions are used in the next
iteration.
    The utility measures defined by the active learning strategies in the litera-
ture [36] differ in their positioning according to a dilemma between the exploita-
tion of the current classifier and the exploration of the training data. Selecting
an unlabelled example in an unknown region of the observation space Rd helps
to explore the data, so as to limit the risk of learning a hypothesis too specific
to the current set L. Conversely, selecting an example in a sampled region of Rd
locally refines the predictive model.



1.1     Traditional heuristic-based AL


The active learning field comes from a parallel between active educational meth-
ods and machine learning theory. The learner is from now a statistical model
and not a student. The interactions between the student and the teacher corre-
spond to the interactions between the model and the oracle. The examples are
situations used by the model to generate knowledge on the problem.
    The first AL algorithms were designed with the objective of transposing these
“educational” methods to the machine learning domain. The easiest way was
to keep the usual supervised learning methods and to add “strategies” relying
on various heuristics to guide the selection of the most informative examples.
From the first initiative and up to now, a lot of strategies motivated by human
intuitions have been suggested in the literature. The purpose of this paper is not
to give an overview of the existing strategies but the reader may find in [36, 1]
of lot of them.
    A careful reading of the experimental results published in the literature shows
that there is no best AL strategy that consistently outperforms all others in all
applications, and some strategies cater to specific classifiers or to specific appli-
cations. Based on this observation, several comprehensive benchmarks carried
out on numerous datasets have highlighted the strategies which, on average, are
the most suitable for several classification models [28, 41, 29]. They are given
in Table 1. For example, the most appropriate strategy for logistic regression
and random forest is an uncertainty-based sampling4 strategy, named margin
sampling, which consists in selecting at each iteration the instance for which
the difference between the probabilities of the two most likely classes is the
smallest [34]. To produce this table, we purposefully omitted studies that have
a restricted scope, such as focusing on too few datasets [4], specific tasks [37],
an insufficient number of strategies [35, 31], or variants of a single strategy [21].

4
    The reader interested in the measures used to quantify the degree of uncertainty in
    the context of active learning may find in [25, 18] an interesting view which advocates
    a distinction between two different types of uncertainty, referred to as epistemic and
    aleatoric.
40      Learning
        Louis    active learning
              Desreumaux         at the crossroads?
                           and Vincent  Lemaire     evaluation and discussion         3


             Strategy RF1 SVM2 5NN3 GNB4 C4.55 LR6 VFDT7

             Margina [29]
             Entropyb                                          [41]
              QBDc                               [28]                 [28]
             Densityd                 [29, 28]          [28]
              OERe             [29]              [29]   [29]
Table 1. Best model/strategy associations highlighted in the literature as a guide to
use the appropriate strategy versus the classifier. Strategies: (a) Margin sampling, (b)
Entropy sampling, (c) Query by Disagreement, (d) Density sampling, (e) Optimistic
Error Reduction. Classifiers: (1) Random Forest, (2) Support Vector Machine, (3) 5-
Nearest Neighbors, (4) Gaussian Naive Bayes, (5) C4.5 Decision Tree, (6) Logistic
Regression, (7) Very Fast Decision Tree.




1.2   Meta-learning approaches to active learning

While the traditional AL strategies can achieve remarkable performance, it is
often challenging to predict in advance which strategy is the most suitable in a
particular situation. In recent years, meta-learning algorithms have been gaining
in popularity [23]. Some of them have been proposed to tackle the problem of
learning AL strategies instead of relying on manually designed strategies.
    Motivated by the success of methods that combine predictors, the first AL
algorithms within this paradigm were designed to combine traditional AL strate-
gies with bandit algorithms [3, 12, 17, 8, 10, 26]. These algorithms learn how to
select the best AL criterion for any given dataset and adapt it over time as the
learner improves. However, all the learning must be achieved within a few exam-
ples to be helpful, and these algorithms suffer from a cold start issue. Moreover,
these approaches are restricted to combining existing AL heuristic strategies.
    Within the meta-learning framework, some other algorithms have been devel-
oped to learn from scratch an AL strategy on multiple source datasets and trans-
fer it to new target datasets [19, 20, 27]. Most of them are based on modern rein-
forcement learning methods. The key challenge consists in learning an AL strat-
egy that is general enough to automatically control the exploitation/exploration
trade-off when used on new unlabelled datasets, which is not possible when using
heuristic strategies.


1.3   Objective of this paper

From the state of the art, it appears that meta-learned AL strategies can outper-
form the most widely used traditional AL strategies, like uncertainty sampling.
However, most of the papers that introduce new meta-learning algorithms do
not include comprehensive benchmarks that could ascertain the transferability
of the learned strategies and demonstrate that these strategies can safely be used
in real-world settings.
4       L. Desreumaux
      Learning          and V. Lemaire
               Active Learning at the Crossroads? Evaluation and Discussion        41

    The objective of this article is thus to compare two possible options in the
realization of an AL solution that could be used in an industrial context: using a
traditional heuristic-based strategy (see Section 1.1) that, on average, is the best
one for a given model and could be used as a strong baseline easy to implement
and not so easy to beat, or using a more sophisticated strategy learned in a
data-driven fashion that comes from the very recent literature on meta-learning
(see Section 1.2).
    To this end, we present the results of a benchmark performed on 20 datasets
that compares a strategy learned using the meta-learning algorithm proposed
in [20] with margin sampling [34], the models used being in both cases logistic re-
gression and random forest. We evaluated the work of [20] since the authors claim
to be able to learn a “general-purpose” AL strategy that can generalise across
diverse problems and outperform the best heuristic and bandit approaches.
    The rest of the paper is organized as follows. In Section 2, we explain all
the aspects of the Learning Active Learning (LAL) method proposed in [20],
namely the Deep Q-Learning algorithm and the modeling of active learning as a
Markov decision process (MDP). In Section 3, we present the protocol used to do
extensive comparative experiments on public datasets from various application
areas. In Section 4, we give the results of our experimental study and make
some observations. Finally, we present some lessons learned and we open future
perspectives in Section 5.


2     Learning active learning strategies

2.1    Q-Learning

A Markov decision process is a formalism for modeling the interaction between
an agent and its environment. This formalism uses the concepts of state, which
describes the situation in which the environment finds itself, action, which de-
scribes the decision made by the agent, and reward, received by the agent when
it performs an action. The procedure followed by the agent to select the action
to be performed at time t is the policy. Given a policy π, the state-action table
is the function Qπ (s, a) which gives the expectation of the weighted sum of the
rewards received from the state s if the agent first executes the action a and
then follows the policy π.
    Q-Learning is a reinforcement learning algorithm that estimates the optimal
state-action table Q? = maxπ Qπ from interactions between the agent and the
environment. The state-action table Q is updated at any time from the current
state s, the action a = π(s) where π is the policy derived from Q, the reward
received r and the next state of the environment s0 :
                                                                            
                                                                       0 0
     Qt+1 (s, a) = (1 − αt (s, a))Qt (s, a) + αt (s, a) r + γ max
                                                               0
                                                                  Qt (s , a )  , (1)
                                                            a ∈A


where γ ∈ [0, 1[ is the weighting factor of the rewards and the αt (s, a) ∈ ]0, 1[ are
the learning steps that determine the weight of the new experience in relation
42     Learning
       Louis    active learning
             Desreumaux         at the crossroads?
                          and Vincent  Lemaire     evaluation and discussion               5

to the knowledge acquired at previous steps. Assuming that all the state-action
pairs are visited an infinite number of times and under some conditions on the
learning steps, the resulting sequence of state-action tables converges to Q? [40].
    The goal of a reinforcement learning agent is to maximize the rewards re-
ceived over the long term. To do this, in addition to actions that seem to lead to
high rewards (exploitation), the agent must select potentially suboptimal actions
that allow him to acquire new knowledge about the environment (exploration).
For Q-Learning, the -greedy method is the most commonly used to manage this
dilemma. It consists in randomly exploring with a probability of  and acting
according to a greedy strategy that chooses the best action with a probability
of (1 − ). It is also possible to decrease the probability  at each transition to
model the fact that exploration becomes less and less useful with time.


2.2   Deep Q-Learning

In the Q-Learning algorithm, if the state-action table is implemented as a two-
input table, then it is impossible to deal with high-dimensional problems. It is
necessary to use a parametric model that will be noted as Q(s, a; θ). If it is a
deep neural network, it is called Deep Q-Learning.
    The training of a neural network requires the prior definition of an error
criterion to quantify the loss between the value returned by the network and the
actual value. In the context of Q-Learning, the latter value does not exist: one
can only use the reward obtained after the completion of an action to calculate
a new value, and then estimate the error achieved by calculating the difference
between the old value and the new one. A possible cost function would thus be
the following:
                                                                           2
                        0                           0       0
            L(s, a, r, s , θ) =       r + γ max
                                             0
                                                Q(s , a ; θ) − Q(s, a; θ)        .        (2)
                                           a ∈A


However, this poses an obvious problem: updating the parameters leads to up-
dating the target. In practice, this means that the training procedure does not
converge.
   In 2013, a successful implementation of Deep Q-Learning introducing several
new features was published [24]. The first novelty is the introduction of a target
network, which is a copy of the first network that is regularly updated. This has
the effect of stabilizing learning. The cost function becomes:
                                                                                2
                    0       −                           0       0   −
         L(s, a, r, s , θ, θ ) =       r + γ max
                                              0
                                                 Q(s , a ; θ ) − Q(s, a; θ)           ,   (3)
                                             a ∈A


where θ − is the vector of the target network parameters. The second nov-
elty is experience replay. It consists in saving each experience of the agent
(si , ai , ri , si+1 ) in a memory of size m and using random samples drawn from
it to update the parameters by stochastic gradient descent. This random draw
allows to not necessarily select consecutive, potentially correlated experiences.
6       L. Desreumaux
      Learning          and V. Lemaire
               Active Learning at the Crossroads? Evaluation and Discussion     43

2.3   Improvements to Deep Q-Learning

Many improvements to Deep Q-Learning have been published since the article
that introduced it. We present here the improvements that interest us for the
study of the LAL method.

Double Deep Q-Learning. A first improvement is the correction of the overesti-
mation bias. It has indeed been empirically shown that Deep Q-Learning as pre-
sented in Section 2.2 can produce a positive bias that increases the convergence
time and has a significant negative impact on the quality of the asymptotically
obtained policy. The importance of this bias and its consequences have been
verified in particular in the configurations the least favourable to its emergence,
i.e. when the environment and rewards are deterministic. In addition, its value
increases with the size of the set of actions. To correct this bias, the solution
which has been proposed in [15] consists in not using the parameters θ − to both
select and evaluate an action. The cost function then becomes:
                                                                            2
               0      −              0              0 0        −
   L(s, a, r, s , θ, θ ) = r + γQ s , arg max
                                            0
                                               Q(s , a ; θ); θ     − Q(s, a; θ) .
                                             a ∈A
                                                                               (4)

Prioritized Experience Replay. Another improvement is the introduction of the
notion of priority in experience replay. In its initial version, Deep Q-Learning
considers that all the experiences can identically advance learning. However,
reusing some experiences at the expense of others can reduce the learning time.
This requires the ability to measure the acceleration potential of learning asso-
ciated with an experience. The priority measure proposed in [33] is the absolute
value of the temporal difference error:

                 δi = ri + γ max
                              0
                                 Q(si+1 , a0 ; θ − ) − Q(si , ai ; θ) .        (5)
                              a ∈A


A maximum priority is assigned to each new experience, so that all the experi-
ences are used at least once to update the parameters.
    However, the experiences that produce a small temporal difference error at
first use may never be reused. To address this issue, a method was introduced
in [33] to manage the trade-off between uniform sampling and sampling focusing
on experiences producing a large error. It consists in defining the probability of
selecting an experience i as follows:

                              ρβ
                       p i = Pm i    β
                                         ,   with ρi = δi + e,                 (6)
                                k=1 ρk

where β ∈ R+ is a parameter that determines the shape of the distribution and
e is a small positive constant that guarantees pi > 0. The case where β = 0 is
equivalent to uniform sampling.
44        Learning
          Louis    active learning
                Desreumaux         at the crossroads?
                             and Vincent  Lemaire     evaluation and discussion        7

2.4     Formulating active learning as a Markov decision process
The formulation of active learning as a MDP is quite natural. In each MDP
state, the agent performs an action, which is the selection of an instance to be
labelled, and the latter receives a reward that depends on the quality of the
model learned with the new instance. The active learning strategy becomes the
MDP policy that associates an action with a state.
    In this framework, the iteration t of the policy learning process from a dataset
divided into a learning set D = Lt ∪Ut and a test set5 D0 consists in the following
steps:
 1. A model h(t) is learned from Lt . Associated with Lt and Ut , it allows to
    characterize a state st .
 2. The agent performs the action at = π(st ) ∈ At which defines the instance
    x(t) ∈ Ut to label.
 3. The label y (t) associated with x(t) is retrieved and the training set is updated,
    i.e. Lt+1 = Lt ∪ {(x(t) , y (t) )} and Ut+1 = Ut \ {x(t) }.
 4. The agent receives the reward rt associated with the performance `t on the
    test set D0 . This reward is used to update the policy (see Section 2.5).
The set of actions At depends on time because it is not possible to select the
same instance several times. These steps are repeated until a terminal state sT is
reached. Here, we consider that we are in a terminal state when all the instances
have been labelled or when `t ≥ q, where q is a performance threshold that has
been chosen as 98% of the performance obtained when the model is learned on
all the training data.
     The precise definition of the set of states, the set of actions and the reward
function is not evident. To define a state, it has been proposed to use a vector
whose components are the scores ybt (x) = P(Y = 0 | x) associated with the
unlabelled instances of a subset V set aside. This is the simplest representation
that can be used to characterize the uncertainty of a classifier on a dataset at a
given time t.
     The set of actions has been defined at iteration t as the set of vectors ai =
 yt (xi ), g(xi , Lt ), g(xi , Ut )], where xi ∈ Ut and :
[b
                      1 X                                        1 X
     g(xi , Lt ) =                dist(xi , xj ), g(xi , Ut ) =       dist(xi , xj ), (7)
                    |Lt |                                       |Ut |
                       xj ∈Lt                                 xj ∈Ut

where dist is the cosine distance. An action is therefore characterized by the
uncertainty on the associated instance, as well as by two statistics related to the
density of the neighbourhood of the instance.
    The reward function has been chosen constant and negative until arrival in a
terminal state (rt = −1). Thus, to maximize its reward, the agent must perform
as few interactions as possible.
5
     Given that active learning is usually applied in cases, this test set assumed to be
     small or very small the performance evaluated on this test set could be a possibly
     bad approximation. This issue and techniques for avoiding it are not examined in
     this paper.
8           L. Desreumaux
          Learning          and V. Lemaire
                   Active Learning at the Crossroads? Evaluation and Discussion                                                                         45

2.5       Learning the optimal policy through Deep Q-Learning

The Deep Q-Learning algorithm with the improvements presented in Section 2.3
is used to learn the optimal policy. To be able to process a state space that evolves
with each iteration, the neural network architecture has been modified. The new
architecture considers actions as inputs to the Q function in the same way as
states. It then returns only one value, while the classical architecture takes only
one state as input and returns the values associated with all the actions.
    The learning procedure involves a collection of Z labelled datasets {Zi }1≤i≤Z .
It consists in repeating the following steps (see Figure 1):

 1. A dataset Z ∈ {Zi } is randomly selected and divided into a training set D
    and a test set D0 .
 2. The policy π derived from the Deep Q-Network is used to simulate several
    active learning episodes on Z according to the procedure described in Sec-
    tion 2.4. Experiences (st , at , rt , st+1 ) are collected in a finite size memory.
 3. The Deep Q-Network parameters are updated several times from a mini-
    batch of experiences extracted from the memory (according to the method
    described in Section 2.3).

    To initialize the Deep Q-Network, some warm start episodes are simulated
using a random sampling policy, followed by several parameter updates. Once
the strategy is learned, its deployment is very simple. At each iteration of the
sampling process, the classifier is re-trained, then the vector characterizing the
process state and all the vectors associated with the actions are calculated. The
vector a? corresponding to the example to label x? is then the one that satisfies
a? = arg maxa∈A Q(s, a; θ), the parameters θ being set at the end of the policy
learning procedure.


 Initial      Simulation of 10 active             Experience replay                         Selection of 32 experiences
examples         learning episodes               memory of size 10 000                       using the probabilities aa
                                                                                                                     pi
                                                                                           + stochastic gradient descent                                ×60
                                                                                                              Q                                     R
                                     T = |U0 |                                                                1 ÿ
                                                                                                                 32
                                                                                       ◊ Ω ◊ ≠ 0.0001 · Ò◊ a        L(sj , aj , rj , sj+1 , ◊, ◊ ≠ )b
                                                                  .                                          32 j=1
                                                                  .
                               ¸Øq
      .                                               (si , ai , ri , si+1 , pi )                        |V| = 30
                     Strategy :
      .       fi(s) = arg max Q(s, a; ◊)          (si+1 , ai+1 , ri+1 , si+2 , pi+1 )        s                …                     a
                         aœA
                                                                  .
                                 ¸Øq                              .
                                                                                                          Deep Q-Network


Fig. 1. Illustration of the different steps involved in an iteration of the policy learning
phase using Deep Q-Learning (the arrows give intuitions about main steps and data
flows)
                                              .
46           Learning
             Louis    active learning
                   Desreumaux         at the crossroads?
                                and Vincent  Lemaire     evaluation and discussion                9

3         Experimental protocol

In this section, we introduce our protocol of the comparative experimental study
we conducted.


3.1        Policy learning

To learn the strategy, we used the same code6 , the same hyperparameters and
the same datasets as those used in [20]. The complete list of hyperparameters
is given in Table 2 with the variable names from the code that represent them.
The datasets from which the strategy is learned are given in Table 3.
    The specification of the neural network architecture is very simple (all the
layers are fully connected): (i) the first layer (linear + sigmoid) receives the
vector s (i.e. |V| = 30 input neurons) and has 10 output neurons; (ii) the second
layer (linear + sigmoid) concatenates the 10 output neurons of the first layer
with the vector a (i.e. 13 neurons in total) and has 5 output neurons; (iii) finally,
the last layer (linear) has only one output to estimate Q(s, a).


             Hyperparameter                                 Description

N STATE ESTIMATION = 30              Size of V
REPLAY BUFFER SIZE = 10000           Experience replay memory size
PRIORITIZED REPLAY EXPONENT = 3      Exponent β involved in Equation (6)
BATCH SIZE = 32                      Minibatch size for stochastic gradient descent
LEARNING RATE = 0.0001               Learning rate
TARGET COPY FACTOR = 0.01            Value that sets the target network update1
EPSILON START = 1                    Exploration probability at start
EPSILON END = 0.1                    Minimum exploration probability
EPSILON STEPS = 1000                 Number of updates of  during the training
WARM START EPISODES = 100            Number of warm start episodes
NN UPDATES PER WARM START = 100      Number of parameter updates after the warm start
TRAINING ITERATIONS = 1000           Number of training iterations
TRAINING EPISODES PER ITERATION = 10 Number of episodes per training iteration
NN UPDATES PER ITERATION = 60        Number of updates per training iteration
     1
         In this implementation, the target network parameters θ − are updated each time the param-
         eters θ are changed as follows: θ − ← (1−TARGET COPY FACTOR)·θ − +TARGET COPY FACTOR·θ.
                    Table 2. Hyperparameters involved in Deep Q-Learning.




3.2        Traditional heuristic-based AL used as baseline: margin
           sampling

Our objective is to compare the performance of a strategy learned using LAL
with the performance of a heuristic strategy that, on average, is the best one for
6
     https://github.com/ksenia-konyushkova/LAL-RL
10      L. Desreumaux
      Learning          and V. Lemaire
               Active Learning at the Crossroads? Evaluation and Discussion         47


                  Dataset     |D| |Y| #num #cat maj (%) min (%)

                australian    690   2      6     8     55.51     44.49
                breast-cancer 272   2      0     9     70.22     29.78
                diabetes      768   2      8     0     65.10     34.90
                german       1000   2      7    13     70.00     30.00
                heart         293   2     13     0     63.82     36.18
                ionosphere    350   2     33     0     64.29     35.71
                mushroom     8124   2      0    21     51.80     48.20
                wdbc          569   2     30     0     62.74     37.26
Table 3. Datasets used to learn the new strategy. Columns: number of examples, num-
ber of classes, numbers of numerical and categorical variables, proportions of examples
in the majority and minority classes.



a given model. Several benchmarks conducted on numerous datasets have high-
lighted the fact that margin sampling is the best heuristic strategy for logistic
regression (LR) and random forest (RF) [41, 29].
    Margin sampling consists in choosing the instance for which the difference (or
margin) between the probabilities of the two most likely classes is the smallest:

                         x? = arg min P(y1 | x) − P(y2 | x),                       (8)
                                    x∈U

where y1 and y2 are respectively the first and second most probable classes for
x. The main advantage of this strategy is that it is easy to implement: at each
iteration, a single training of the model and |U| predictions are sufficient to
select an example to label. A major disadvantage, however, is its total lack of
exploration, as it only exploits locally the hypothesis learned by the model.
    We chose to evaluate the Margin/LR association because it is with logistic
regression that the hyperparameters of Table 2 were optimized in [20]. In addi-
tion, in order to determine whether it is necessary to modify them when another
model is used, we also evaluated the Margin/RF association. This last associa-
tion is particularly interesting because it is the best association highlighted in a
recent and large benchmark carried out on 73 datasets, including 5 classification
models and 8 active learning strategies [29]. In addition, we evaluated random
sampling (Rnd) for both models.


3.3   Datasets

The datasets were selected so as to have a high diversity according to the fol-
lowing criteria: (i) number of examples; (ii) number of numerical variables; (iii)
number of categorical variables; (iv) class imbalance.
   We have also taken care to exclude datasets that are too small and not
representative of those used in an industrial context. The 20 selected datasets
are described in Table 4. They all come from the UCI database [11], apart
from the dataset “orange-fraud” which is dataset on fraud detection. Four of
48         Learning
           Louis    active learning
                 Desreumaux         at the crossroads?
                              and Vincent  Lemaire     evaluation and discussion             11

the datasets have been used in a challenge on active learning that took place
in 2010 [14] and the dataset “nomao” comes from another challenge on active
learning [6].


                   Dataset                |D| |Y| #num #cat maj (%) min (%)

             adult                     48790    2       6      8     76.06     23.94
             banana                     5292    2       2      0     55.16     44.84
             bank-marketing-full       45211    2       7      9     88.30     11.70
             climate-simulation-craches 540     2      20      0     91.48      8.52
             eeg-eye-state             14980    2      14      0     55.12     44.88
             hiva                      40764    2    1617      0     96.50      3.50
             ibn-sina                  13951    2      92      0     76.18     23.82
             magic                     18905    2      10      0     65.23     34.77
             musk                       6581    2     166      1     84.55     15.45
             nomao                     32062    2      89     29     69.40     30.60
             orange-fraud               1680    2      16      0     63.75     36.25
             ozone-onehr                2528    2      72      0     97.11      2.89
             qsar-biodegradation        1052    2      41      0     66.35     33.65
             seismic-bumps              2578    2      14      4     93.41      6.59
             skin-segmentation         51444    2       3      0     71.51     28.49
             statlog-german-credit      1000    2       7     13     70.00     30.00
             thoracic-surgery            470    2       3     13     85.11     14.89
             thyroid-hypothyroid        3086    2       7     18     95.43      4.57
             wilt                       4819    2       5      0     94.67      5.33
             zebra                     61488    2     154      0     95.42      4.58
Table 4. Datasets used for the evaluation of the strategy learned by LAL. Columns:
number of examples, number of classes, numbers of numerical and categorical variables,
proportions of examples in the majority and minority classes.




3.4      Evaluation criteria

In our evaluation protocol, the active sampling process begins with the random
selection of one instance in each class and ends when 250 instances are labelled.
This value ensures that our results are comparable to other studies in the liter-
ature. For performance comparison, we used the area under the learning curve
(ALC) based on the classification accuracy. We do not claim that the ALC is
a “perfect metric”7 but it is the defacto standard evaluation criterion in active
learning, and it has been chosen as part of a challenge [14].
    Our evaluation was carried out by cross-validation with 5 partitions, in which
class imbalance within the complete dataset was preserved. For each partition,
the sampling process was repeated 5 times with different initializations to get a
7
     There is literature on more expressive summary statistics of the active-learning curve
     [39, 30]. This could be a limitation of this current article, other metrics could be tester
     in future versions of experiments.
12     L. Desreumaux
     Learning          and V. Lemaire
              Active Learning at the Crossroads? Evaluation and Discussion          49

mean and a variance on the result. However, we have made sure that the initial
instances are identical for all the strategy/model associations on each partition
so as to not introduce bias into the results. In addition, for Rnd, the random
sequence of numbers was identical for all the models.


4    Results
The results of our experimental study are given in Table 5. The mean ALC ob-
tained for each dataset/classifier/strategy association are reported (the optimal
score is 100). The left part of the table gives the results for logistic regression
and the right part gives the results for random forest. The penultimate line cor-
responds to the averages calculated on all the datasets and the last line gives
the number of times the strategy has won, tied or lost. The non-significant dif-
ferences were established on the basis of a paired t-test at 99% significance level
(where H0: same mean between populations and where the mean is the estimate
out of 5 repetitions x cross-validation with 5 partitions of each method).


     Dataset            Rnd/LR Margin/LR LAL/LR Rnd/RF Margin/RF LAL/RF maj

adult                    77.93    78.91      78.97    80.17     81.27   81.21    76.06
banana                   53.03    57.39      53.12    80.24     73.81   73.58    55.16
bank-marketing-full      86.85    87.62      87.72    88.19     88.34   88.49    88.30
climate-simulation       87.22    89.13      88.62    91.15     91.14   91.13    91.48
eeg-eye-state            56.08    55.32      56.11    65.53     67.58   64.42    55.12
hiva                     64.43    70.84      71.80    96.32     96.47   96.44    96.50
ibn-sina                 84.77    88.58      88.90    90.53     93.41   92.75    76.18
magic                    76.49    77.93      77.64    78.05     80.79   79.68    65.23
musk                     83.73    82.34      81.95    89.55     96.18   95.35    84.55
nomao                    89.45    91.43      91.37    89.41     92.32   92.07    69.40
orange-fraud             76.70    81.74      74.26    89.15     90.66   90.48    63.75
ozone-onehr              92.90    94.26      95.06    96.61     96.83   96.89    97.11
qsar-biodegradation      80.98    82.62      83.53    80.34     82.76   82.40    66.35
seismic-bumps            90.87    92.59      92.14    92.48     92.92   93.02    93.41
skin-segmentation        77.05    82.69      83.21    91.51     95.70   95.77    71.51
statlog-german-credit    70.76    72.12      72.34    72.25     72.93   72.78    70.00
thoracic-surgery         83.76    83.93      82.72    83.51     84.41   84.18    85.11
thyroid-hypothyroid      97.21    97.99      97.97    97.75     98.77   98.71    95.43
wilt                     93.53    95.18      92.87    94.86     97.23   97.02    94.67
zebra                    86.40    90.31      91.36    94.71     95.54   95.25    95.42

Mean                     80.51     82.65     82.08    87.12     88.45    88.08   79.53
win/tie/loss            0/5/15    3/15/2    2/15/3   1/4/15    3/16/1   0/16/4

                        Table 5. Results of the experimental study.



    Several observations can be made. First of all, it should be noted that the
choice of model is decisive: the results of random forest are all better than those
of logistic regression. The random forest model learns indeed very well from few
data, as highlighted in [32]. We can notice that even with random sampling, RF is
almost always better than LR, regardless of the strategy used. In addition, using
50         Learning
           Louis    active learning
                 Desreumaux         at the crossroads?
                              and Vincent  Lemaire     evaluation and discussion                                    13

margin sampling with this model allows a significant performance improvement.
This model is very competitive in itself because by its nature, it includes terms
of exploration and exploitation (see Section 5 Conclusion about this point).
    In addition, the results of the learned strategy clearly show that a good
active learning strategy has been learned, since it performs better than random
sampling over a large number of datasets. However, the learned strategy is no
better than margin sampling. These results are nevertheless very interesting
since only 8 datasets were used in the learning procedure.
    Finally, the results show a well-known fact about active learning: on very
unbalanced datasets, it is difficult to achieve a better performance than random
sampling, as shown in the last column of Table 5 in which the results obtained
by always predicting the majority class are given. The “cold start” problem that
occurs in active learning, i.e. the inability of making reliable predictions in early
iterations (when training data is not sufficient), is indeed further aggravated
when a dataset has highly imbalanced classes, since the selected samples are
likely to belong to the majority class [38]. However, if the imbalance is known, it
may be interesting to associate strategies with a model or criterion appropriate
to this case, as illustrated in [13].
    To investigate the “learning speed”, we show results for different sizes of L
in Table 6. They lead to similar conclusions and our results for |L| = 32 confirm
the results of [32]. The reader may find all our experimental results on Github8 .


                        |L| = 32                 |L| = 64                 |L| = 128                 |L| = 250
     Dataset Rnd Margin LAL Rnd Margin LAL Rnd Margin LAL Rnd Margin LAL

    adult       77.95    77.88     78.16 79.72    80.51     81.05 81.13     82.79     82.48 82.12     83.55     83.40
    banana      71.13    65.48     65.16 77.93    71.42     70.96 83.64     75.58     75.70 86.55     79.71     81.35
    bank...     88.05    87.90     88.10 88.29    88.38     88.54 88.43     88.82     88.90 88.75     89.21     89.35
    climate... 91.26     91.26     91.18 91.40    91.29     91.40 91.26     91.33     91.33 91.44     91.22     91.29
    eeg...      58.28    58.94     57.34 62.07    63.17     60.79 66.77     69.38     65.35 72.55     75.08     72.46
    hiva        96.36    96.52     96.49 96.36    96.55     96.54 96.46     96.57     96.56 96.49     96.65     96.65
    ibn-sina 86.88       91.17     89.78 90.48    93.99     92.96 92.73     94.76     94.25 93.86     95.85     95.48
    magic       71.99    75.63     72.95 76.85    80.20     77.26 80.15     82.71     82.01 82.42     84.53     84.43
    musk        85.29    89.50     90.09 87.43    94.44     94.18 90.58     98.78     97.63 93.64     99.98     99.31
    nomao       85.92    89.35     89.37 88.92    92.46     92.09 90.85     93.69     93.33 92.36     94.52     94.37
    orange... 88.06      90.36     90.09 89.16    90.98     90.67 90.08     91.72     91.33 90.41     91.85     91.74
    ozone...    96.36    96.97     97.01 96.74    97.04     97.10 96.93     97.08     97.11 97.02     97.03     97.05
    qsar...     75.75    78.08     76.61 79.75    82.09     81.42 81.94     84.65     84.88 84.03     86.12     86.08
    seismic... 92.39     93.21     93.19 92.42    93.28     93.19 92.52     93.26     93.20 93.14     93.08     93.28
    skin...     86.42    89.19     89.46 90.80    96.19     96.06 93.70     98.86     98.65 95.85     99.56     99.49
    statlog... 70.36     70.70     69.70 70.94    72.47     71.75 72.40     73.46     74.10 74.29     75.22     75.06
    thoracic... 83.14    84.42     84.12 83.31    85.02     84.76 83.70     84.89     84.68 84.21     84.51     84.68
    thyroid... 97.26     98.71     98.43 97.86    99.15     98.71 98.08     99.10     98.89 98.26     98.84     98.98
    wilt        94.60    96.23     95.98 95.01    97.47     96.90 95.30     98.21     97.64 96.07     98.51     98.37
    zebra       94.66    95.32     95.28 94.87    95.44     95.31 94.96     95.72     95.46 95.01     96.04     95.33

    Mean       84.60 85.84 85.42 86.51 88.07 87.58 88.08 89.56 89.17 89.42 90.55 90.40

Table 6. Mean test accuracy (%) for different sizes of |L| with the random forest
model.
8
     https://github.com/ldesreumaux/lal_evaluation
14     L. Desreumaux
     Learning          and V. Lemaire
              Active Learning at the Crossroads? Evaluation and Discussion        51

5    Discussion and open questions
In this article, we evaluated a method representative of a recent orientation of
active learning research towards meta-learning methods for “learning how to
actively learn”, which is on top of the state of the art [20], versus a traditional
heuristic-based Active Learning (the association of Random Forest and Margin)
which is one of the best method reported in recent comparative studies [41, 29].
The comparison is limited to just one representative of each of the two classes
(meta-learning and traditional heuristic-based) but since each is on top of the
state of the art several lessons can be drawn from our study.

Relevance of LAL. First of all, the experiments carried out confirm the relevance
of the LAL method, since it has enabled us to learn a strategy that achieves the
performance of a very good heuristic, namely margin sampling, but contrary
to the results in [20], the strategy is not always better than random sampling.
This method still raises many problems, including that of the transferability
of the learned strategies. An active learning solution that can be used in an
industrial context must perform well on real data of an unknown nature and
must not involve parameters to be adjusted. With regard to the LAL method, a
first major problem is therefore the constitution of a “dataset of datasets” large
and varied enough to learn a strategy that is effective in very different contexts.
    Moreover, the learning procedure is sensitive to the performance criteria used,
which in our view seems to be a problem. Ideally, the strategy learned should
be usable on new datasets with arbitrary performance criteria (AUC, F-score,
etc.). From our point of view, the work of optimizing the many hyperparameters
of the method (see Table 2) can not be carried out by a user with no expertise
in deep reinforcement learning.

About the Margin/RF association. In addition to the evaluation of the LAL
method, we confirmed a result of [29], namely that margin sampling, associated
with a random forest, is a very competitive strategy. From an industrial point
of view, regarding the computational complexity, the performances obtained
and the absence of “domain knowledge required to be used” the Margin/RF
association remains a very strong baseline difficult to beat. However, it shares a
major drawback with many active learning strategies, that is its lack of reliability.
Indeed, there is no strategy that is better or equivalent to random sampling on
all datasets and with all models. The literature on active learning is incomplete
with regard to this problem, which is nevertheless a major obstacle to using
active learning in real-world settings.
    Another important problem in real-world applications, little studied in the
literature, is the estimation of the generalization error without a test set. It
would be interesting to check if the Out-Of-Bag samples of the random forests
[5] can be used in an active learning context to estimate this error.
    Concerning the exploitation/exploration dilemma, margin sampling clearly
performs only exploitation. The good results of the Margin/RF association may
suggest that the RF algorithm intrinsically contains a part of exploration due to
52        Learning
          Louis    active learning
                Desreumaux         at the crossroads?
                             and Vincent  Lemaire     evaluation and discussion       15

the bagging paradigm. It could be interesting to add experiments in the future
to test this point.
    Still with regard to the random forests, an open question is to study if a better
strategy than margin sampling could be designed. Since the random forests are
ensemble classifiers, a possible way of research to design this strategy is to check
if they could be used in the credal uncertainty framework [2] which seeks to
differentiate between the reducible and irreducible part of the uncertainty in a
prediction.

About error generalization. In Real world application AL should be used most of
the time in absence of a test dataset. A open question could be to a use another
known result about RF: the possibility to have an estimate of the generalization
error using the Out-Of-Bag (OOB) samples [16, 5]. We did not present experi-
ments on this topic in this paper but an idea could be to analyze the convergence
versus the number of labelled examples between the OOB performance and the
test performance to check at which “moment” (|L|) one could trust9 the OOB
performance (OOB performance ≈ test performance). The use of a “random
uniform forest” [9] for which the OOB performance seems to be more reliable
could also be investigated.

About the benchmarking methodology. Recent benchmarks have highlighted the
need for extensive experimentation to compare active learning strategies. The
research community might benefit from a “reference” benchmark, as in the field
of time series classification [7], so that new results can be rigorously compared
to the state of the art on a same and large set of datasets. By this way, one will
have comprehensive benchmarks that could ascertain the transferability of the
learned strategies and demonstrate that these strategies can safely be used in
real-world settings.
    If this reference benchmark is created, the second step would be to decide
how to compare the AL strategies. This comparison could be made using not
a single criterion but a “pool” of criteria. This pool may be chosen to reflect
different “aspects” of the results [22].


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