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Learning Bayesian networks
Slides by Nir Friedman and Dan Geiger .
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Known Structure - Complete Data
X, Y <h, t > <h, h> <h, h > <t, t > <h, t> <t, h > <h, h> <h, h> N=10 NX=h = 7 NX=t = 3 X Y NY=h | X=h = 5 NY=t | X=h = 2 Let = {x , y|x , y|~x } be the parameters of the Bayes Net. NY=h | X=t = 1 NY=t | X=t = 2 Each parameter is estimated separately say via the maximum likelihood principle or using say a prior Beta(e,e): x =NX=h/(NX=h+NX=t) = 7/(7+3), or (7+e)/(7+3+2e), y|x =NY=h|X=h/(NY=h|X=h+NY=t|X=h) = 5/(5+2), or (5+e)/(5+2+2e), y |~x =NY=h|X=t/(NY=h|X=t+NY=t|X=t) = 1/(1+2) or (1+e)/(1+2+2e).
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Why independent estimations?
= {x , y|x , y|~x } are the parameters of the Bayes Net: X Y P(X,Y) = P(X) P(Y|X) P(,X,Y) =P() P(X| ) P(Y|X, ) Definition: Global Parameter Independence means that all parameters of vertex X are marginally independent of all parameters of vertex Y for all vertices X,Y. P() = P(x , y|x , y|~x) = P(x) P(y|x , y|~x) Definition: Local Parameter Independence means that all parameters of vertex X are marginally independent of each other for every vertex X. P(y|x , y|~x) = P(y|x) P(y|~x)
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Why independent estimations?
= {x , y|x , y|~x } are the parameters of the Bayes Net: X Y P(,X=x,Y=y) =P() P(X=x| ) P(Y=y|X=x, ) P() = P(x , y|x , y|~x) = P(x) P(y|x) P(y|~x) P(X=x | ) = P(X=x | x) = x P(Y=y |X=x, ) = P(Y=y |X=x, y|x , y|~x) = y|x P(,X=x,Y=y) = [P(x) x ] [P(y|x) y|x ] [ P(y|~x)]
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Why independent estimations?
= {x , y|x , y|~x } are the parameters of the Bayes Net: X Y P(,X=~x,Y=y) =P() P(X=~x| ) P(Y=y|X=~x, ) P() = P(x , y|x , y|~x) = P(x) P(y|x) P(y|~x) P(X=~x | ) = P(X=~x | x) = 1-x P(Y=y |X=~x, ) = P(Y=y |X=~x, y|x , y|~x) = y|~x P(,X,Y) = [P(x) (1-x)] [P(y|x) ][P(y|~x) y|~x]
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Known Structure - Complete Data
Complete Data = { (X1,Y1), (X2,Y2),…, (Xn,Yn)} P( |Data) = K P() P(Data | ) =K P(x) P(y|x) P(y|~x) 𝑖=1 𝑛 P(Xi,Yi|) P(|Data) = K P(x) P(y|x) P(y|~x) 𝑖=1 𝑛 P(Xi|x)P(Yi|Xi,y|x ,y|~x)
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Why independent estimations?
Complete Data Points= { (X1,Y1), (X2,Y2),…, (Xn,Yn)} Counts: NX=x ,NX=~x ,NY=y|X=x ,NY=~y|X=x ,NY=y|X=~x ,NY=~y|X=~x P(|Data) =K∙P(x) ∙ P(y|x)∙P(y|~x)∙ 𝑖=1 𝑛 P(Xi|x)P(Yi|Xi,y|x ,y|~x) P(|Data) = K ∙[ P(x) ∙ 𝑖=1 𝑛 P(Xi|x)] ∙ [P(y|x) ∙ 𝑖:𝑋𝑖=𝑥 P(Yi|Xi,y|x)]∙ [P(y|~x) ∙ 𝑖:𝑋𝑖=~𝑥 P(Yi|Xi, y|~x)] P(|Data) = K ∙[ P(x) ∙[x] NX=x ∙ [1-x] NX=~x]∙ [P(y|x) ∙ [y|x] NY=y|X=x ∙ [1-y|x] NY=~y|X=x ]∙ [P(y|~x) ∙ [y|~x] NY=y|X=~x ∙ [1-y|~x] NY=~y|X=~x ]
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Summary for independent estimations
P(|Data) = K ∙[ P(x) ∙[x] NX=x ∙ [1-x] NX=~x]∙ [P(y|x) ∙ [y|x] NY=y|X=x ∙ [1-y|x] NY=~y|X=x ]∙ [P(y|~x) ∙ [y|~x] NY=y|X=~x ∙ [1-y|~x] NY=~y|X=~x ] Three Conjugate Beta priors with hyper-parameters, Imaginary Counts: nX=x ,nX=~x ,nY=y|X=x ,nY=~y|X=x ,nY=y|X=~x ,nY=~y|X=~x P(|Data) = K∙[ Beta(x; nX=x ,nX=~x) ∙[x] NX=x ∙ [1-x] NX=~x]∙ [Beta(y|x; nY=y|X=x ,nY=~y|X=x) ∙ [y|x] NY=y|X=x ∙ [1-y|x] NY=~y|X=x ]∙ [Beta(y|~x; nY=y|X=~x ,nY=~y|X=~x) ∙ [y|~x] NY=y|X=~x ∙ [1-y|~x] NY=~y|X=~x ] Maximum Likelihood Estimates: MaximumP(Data |) =[ [x] NX=x ∙ [1-x] NX=~x]∙ [ [y|x] NY=y|X=x ∙ [1-y|x] NY=~y|X=x ]∙ [ [y|~x] NY=y|X=~x ∙ [1-y|~x] NY=~y|X=~x ]
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Known Structure - Complete Data
X, Y <h, t > <h, h> <h, h > <t, t > <h, t> <t, h > <h, h> <h, h> N=10 NX=h = 7 NX=t = 3 X Y NY=h | X=h = 5 NY=t | X=h = 2 Let = {x , y|x , y|~x } be the parameters of the Bayes Net. NY=h | X=t = 1 NY=t | X=t = 2 Each parameter is estimated separately say via the maximum likelihood principle or using say a prior Beta(e,e): x =NX=h/(NX=h+NX=t) = 7/(7+3), or (7+e)/(7+3+2e), y|x =NY=h|X=h/(NY=h|X=h+NY=t|X=h) = 5/(5+2), or (5+e)/(5+2+2e), y |~x =NY=h|X=t/(NY=h|X=t+NY=t|X=t) = 1/(1+2) or (1+e)/(1+2+2e).
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Known Structure - Incomplete Data
Incomplete Data = { (?,Y1), (X2,?),…, (Xn,Yn)}
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Learning Parameters from Incomplete Data
X Y|X=H m X[m] Y[m] Y|X=T Incomplete data: Posterior distributions can become dependent Consequence: ML parameters can not be computed separately Posterior is not a product of independent posteriors No Longer A unimodal “Nice” Likelihood function or Posterior
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Known Structure -- Incomplete Data
E, B, A <Y,N,N> <Y,?,Y> <N,N,Y> <N,Y,?> . <?,Y,Y> E B A Inducer .9 .1 e b .7 .3 .99 .01 .8 .2 B E P(A | E,B) ? e b B E P(A | E,B) E B A Network structure is specified Data contains missing values We will consider filling assignments to missing values
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Expectation Maximization (EM)
A general purpose method for learning from incomplete data Intuition: If we had access to counts, then we can estimate parameters However, missing values do not allow to perform counts “Complete” counts using current parameter assignment
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Expectation Maximization (EM)
Y Z Data Expected Counts P(Y=H|X=H,Z=T,) = 0.3 X Y Z N (X,Y ) HTHHT ??HTT TT?TH X Y # Current model HTHT HHTT These numbers are placed for illustration; they have not been computed. P(Y=H|X=T, Z=T, ) = 0.4
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EM (cont.) Training Data Reiterate Expected Counts
Initial network (G,0) Reparameterize X1 X2 X3 H Y1 Y2 Y3 Updated network (G,1) (M-Step) Expected Counts N(X1) N(X2) N(X3) N(H, X1, X1, X3) N(Y1, H) N(Y2, H) N(Y3, H) Computation (E-Step) X1 X2 X3 H Y1 Y2 Y3 Training Data
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MLE from Incomplete Data
Finding MLE parameters: nonlinear optimization problem Expectation Maximization (EM): Use “current point” to construct alternative function (which is “nice”) Guaranty: maximum of new function is better scoring than the current point L(|D)
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EM in Practice Initial parameters: Random parameters setting
“Best” guess from other source Stopping criteria: Small change in likelihood of data Small change in parameter values Avoiding bad local maxima: Multiple restarts Early “pruning” of unpromising ones
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The setup of the EM algorithm
We start with a likelihood function parameterized by . The observed quantity is denoted X=x. It is often a vector x1,…,xL of observations (e.g., evidence for some nodes in a Bayesian network). The hidden quantity is a vector Y=y (e.g. states of unobserved variables in a Bayesian network). The quantity y is defined such that if it were known, the likelihood of the completed data point P(x,y|) is easy to maximize. The log-likelihood of an observation x has the form: log P(x| ) = log P(x,y| ) – log P(y|x,) (Because P(x,y| ) = P(x| ) P(y|x, )).
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The goal of EM algorithm
The log-likelihood of an observation x has the form: log P(x| ) = log P(x,y| ) – log P(y|x,) The goal: Starting with a current parameter vector ’, EM’s goal is to find a new vector such that P(x| ) > P(x| ’) with the highest possible difference. The result: After enough iterations EM reaches a local maximum of the likelihood P(x| ).
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The Mathematics involved
Recall that the expectation of a random variable Y with a pdf P(y) is given by E[Y] = y y p(y). The expectation of a function L(Y) is given by E[ L(Y)] = y L(y) p(y). A bit harder to comprehend example (where we choose L(Y) log p(x ,y|) with X, as constants): E’[log p(x,y|)] = y p(y|x, ’) log p(x ,y|) The expectation operator E is linear. For two random variables X,Y, and constants a,b, the following holds E[aX+bY] = a E[X] + b E[Y] Q( |’)
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The Mathematics involved (Cont.)
Starting with log P(x| ) = log P(x, y| ) – log P(y|x, ), multiplying both sides by P(y|x ,’), and summing over y, yields Log P(x |) = P(y|x, ’) log P(x ,y|) - P(y|x, ’) log P(y |x, ) y = E’[log p(x,y|)] = Q( |’) We now observe that = log P(x| ) – log P(x|’) = Q( | ’) – Q(’ | ’) + P(y|x, ’) log [P(y |x, ’) / P(y |x, )] y 0 (relative entropy) So choosing * = argmax Q(| ’) maximizes the difference , and repeating this process leads to a local maximum of log P(x| ).
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The EM algorithm itself
Input: A likelihood function p(x,y| ) parameterized by . Initialization: Fix an arbitrary starting value ’ Repeat E-step: Compute Q( | ’) = E’[log P(x,y| )] M-step: ’ argmax Q(| ’) Until = log P(x| ) – log P(x|’) < Comment: At the M-step one can actually choose any ’ as long as > 0. This change yields the so called Generalized EM algorithm. It is important when argmax is hard to compute.
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Comment on the proof of EM
We used a log-likelihood of one observation x of the form: log P(x| ) = log P(x,y| ) – log P(y|x,) For independent points (xi, yi), i=1,…,m, we can similarly write: i log P(xi| ) = i log P(xi,yi| ) – i log P(yi|xi,) We have stick to one observation in our derivation but all derived equations can be modified to set of points by summing over x.
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Expectation Maximization (EM)
In practice, EM converges rather quickly at start but converges slowly near the (possibly-local) maximum. Hence, often EM is used few iterations and then Gradient Ascent steps are applied.
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MLE from Incomplete Data
Finding MLE parameters: nonlinear optimization problem Gradient Ascent: Follow gradient of likelihood w.r.t. to parameters L(|D)
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MLE from Incomplete Data
Both Ideas: Find local maxima only. Require multiple restarts to find approximation to the global maximum.
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Gradient Ascent Main result Theorem GA:
Requires computation: P(xi,pai|o[m],) for all i, m Inference replaces taking derivatives.
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Gradient Ascent (cont)
Proof: å Q = m pa x i o P D , ) | ] [ ( log q å Q = m pa x i o P , ) | ] [ ( 1 q How do we compute ?
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Gradient Ascent (cont)
Since: i pa x o P , ' ) | ( q Q = å i pa x nd d o P , ' ) | ( q Q = å =1 i pa x ' , nd d P o ) | ( q Q = i pa x o P ' , ) ( q Q =
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Gradient Ascent (cont)
Putting all together we get
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