Github user tgaloppo commented on a diff in the pull request: https://github.com/apache/spark/pull/3022#discussion_r21683030 --- Diff: mllib/src/main/scala/org/apache/spark/mllib/clustering/GMMExpectationMaximization.scala --- @@ -0,0 +1,283 @@ +/* + * Licensed to the Apache Software Foundation (ASF) under one or more + * contributor license agreements. See the NOTICE file distributed with + * this work for additional information regarding copyright ownership. + * The ASF licenses this file to You under the Apache License, Version 2.0 + * (the "License"); you may not use this file except in compliance with + * the License. You may obtain a copy of the License at + * + * http://www.apache.org/licenses/LICENSE-2.0 + * + * Unless required by applicable law or agreed to in writing, software + * distributed under the License is distributed on an "AS IS" BASIS, + * WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. + * See the License for the specific language governing permissions and + * limitations under the License. + */ + +package org.apache.spark.mllib.clustering + +import breeze.linalg.{DenseVector => BreezeVector, DenseMatrix => BreezeMatrix} +import breeze.linalg.{Transpose, det, inv} +import org.apache.spark.rdd.RDD +import org.apache.spark.mllib.linalg.{Matrices, Vector, Vectors} +import org.apache.spark.{Accumulator, AccumulatorParam, SparkContext} +import org.apache.spark.SparkContext.DoubleAccumulatorParam + +/** + * Expectation-Maximization for multivariate Gaussian Mixture Models. + * + */ +object GMMExpectationMaximization { + /** + * Trains a GMM using the given parameters + * + * @param data training points stored as RDD[Vector] + * @param k the number of Gaussians in the mixture + * @param maxIterations the maximum number of iterations to perform + * @param delta change in log-likelihood at which convergence is considered achieved + */ + def train(data: RDD[Vector], k: Int, maxIterations: Int, delta: Double): GaussianMixtureModel = { + new GMMExpectationMaximization().setK(k) + .setMaxIterations(maxIterations) + .setDelta(delta) + .run(data) + } + + /** + * Trains a GMM using the given parameters + * + * @param data training points stored as RDD[Vector] + * @param k the number of Gaussians in the mixture + * @param maxIterations the maximum number of iterations to perform + */ + def train(data: RDD[Vector], k: Int, maxIterations: Int): GaussianMixtureModel = { + new GMMExpectationMaximization().setK(k).setMaxIterations(maxIterations).run(data) + } + + /** + * Trains a GMM using the given parameters + * + * @param data training points stored as RDD[Vector] + * @param k the number of Gaussians in the mixture + * @param delta change in log-likelihood at which convergence is considered achieved + */ + def train(data: RDD[Vector], k: Int, delta: Double): GaussianMixtureModel = { + new GMMExpectationMaximization().setK(k).setDelta(delta).run(data) + } + + /** + * Trains a GMM using the given parameters + * + * @param data training points stored as RDD[Vector] + * @param k the number of Gaussians in the mixture + */ + def train(data: RDD[Vector], k: Int): GaussianMixtureModel = { + new GMMExpectationMaximization().setK(k).run(data) + } +} + +/** + * This class performs multivariate Gaussian expectation maximization. It will + * maximize the log-likelihood for a mixture of k Gaussians, iterating until + * the log-likelihood changes by less than delta, or until it has reached + * the max number of iterations. + */ +class GMMExpectationMaximization private ( + private var k: Int, + private var delta: Double, + private var maxIterations: Int) extends Serializable { + + // Type aliases for convenience + private type DenseDoubleVector = BreezeVector[Double] + private type DenseDoubleMatrix = BreezeMatrix[Double] + + // number of samples per cluster to use when initializing Gaussians + private val nSamples = 5; + + // A default instance, 2 Gaussians, 100 iterations, 0.01 log-likelihood threshold + def this() = this(2, 0.01, 100) + + /** Set the number of Gaussians in the mixture model. Default: 2 */ + def setK(k: Int): this.type = { + this.k = k + this + } + + /** Set the maximum number of iterations to run. Default: 100 */ + def setMaxIterations(maxIterations: Int): this.type = { + this.maxIterations = maxIterations + this + } + + /** + * Set the largest change in log-likelihood at which convergence is + * considered to have occurred. + */ + def setDelta(delta: Double): this.type = { + this.delta = delta + this + } + + /** Machine precision value used to ensure matrix conditioning */ + private val eps = math.pow(2.0, -52) + + /** Perform expectation maximization */ + def run(data: RDD[Vector]): GaussianMixtureModel = { + val ctx = data.sparkContext + + // we will operate on the data as breeze data + val breezeData = data.map{ u => u.toBreeze.toDenseVector }.cache() + + // Get length of the input vectors + val d = breezeData.first.length + + // For each Gaussian, we will initialize the mean as the average + // of some random samples from the data + val samples = breezeData.takeSample(true, k * nSamples, scala.util.Random.nextInt) + + // C will be array of (weight, mean, covariance) tuples + // we start with uniform weights, a random mean from the data, and + // diagonal covariance matrices using component variances + // derived from the samples + var C = (0 until k).map(i => (1.0/k, + vec_mean(samples.slice(i * nSamples, (i + 1) * nSamples)), + init_cov(samples.slice(i * nSamples, (i + 1) * nSamples))) + ).toArray + + val acc_w = new Array[Accumulator[Double]](k) + val acc_mu = new Array[Accumulator[DenseDoubleVector]](k) + val acc_sigma = new Array[Accumulator[DenseDoubleMatrix]](k) + + var llh = Double.MinValue // current log-likelihood + var llhp = 0.0 // previous log-likelihood + + var i, iter = 0 + do { + // reset accumulators + for(i <- 0 until k){ + acc_w(i) = ctx.accumulator(0.0) + acc_mu(i) = ctx.accumulator( + BreezeVector.zeros[Double](d))(DenseDoubleVectorAccumulatorParam) + acc_sigma(i) = ctx.accumulator( + BreezeMatrix.zeros[Double](d,d))(DenseDoubleMatrixAccumulatorParam) + } + + val log_likelihood = ctx.accumulator(0.0) + + // broadcast the current weights and distributions to all nodes + val dists = ctx.broadcast((0 until k).map(i => + new MultivariateGaussian(C(i)._2, C(i)._3)).toArray) + val weights = ctx.broadcast((0 until k).map(i => C(i)._1).toArray) + + // calculate partial assignments for each sample in the data + // (often referred to as the "E" step in literature) + breezeData.foreach(x => { + val p = (0 until k).map(i => + eps + weights.value(i) * dists.value(i).pdf(x)).toArray + val norm = sum(p) + + log_likelihood += math.log(norm) + + // accumulate weighted sums + val xxt = x * new Transpose(x) + for(i <- 0 until k){ + p(i) /= norm + acc_w(i) += p(i) + acc_mu(i) += x * p(i) + acc_sigma(i) += xxt * p(i) + } + }) + + // Collect the computed sums + val W = (0 until k).map(i => acc_w(i).value).toArray + val MU = (0 until k).map(i => acc_mu(i).value).toArray + val SIGMA = (0 until k).map(i => acc_sigma(i).value).toArray + + // Create new distributions based on the partial assignments + // (often referred to as the "M" step in literature) + C = (0 until k).map(i => { + val weight = W(i) / sum(W) + val mu = MU(i) / W(i) + val sigma = SIGMA(i) / W(i) - mu * new Transpose(mu) + (weight, mu, sigma) + }).toArray + + llhp = llh; // current becomes previous + llh = log_likelihood.value // this is the freshly computed log-likelihood + iter += 1 + } while(iter < maxIterations && Math.abs(llh-llhp) > delta) + + // Need to convert the breeze matrices to MLlib matrices + val weights = (0 until k).map(i => C(i)._1).toArray + val means = (0 until k).map(i => Vectors.fromBreeze(C(i)._2)).toArray + val sigmas = (0 until k).map(i => Matrices.fromBreeze(C(i)._3)).toArray + new GaussianMixtureModel(weights, means, sigmas) + } + + /** Sum the values in array of doubles */ + private def sum(x : Array[Double]) : Double = { + var s : Double = 0.0 + (0 until x.length).foreach(j => s += x(j)) + s + } + + /** Average of dense breeze vectors */ + private def vec_mean(x : Array[DenseDoubleVector]) : DenseDoubleVector = { --- End diff -- This does not work; the compiler can not find a suitable implicit conversion for the array of vectors when attempting x.sum
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