Graph clustering improved using Boltzmann machine heuristics.
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New method models aptamer libraries as Boltzmann-weighted graph ensembles for better affinity predictions.
DECAF optimizes molecular graphs for ensemble properties, improving drug design accuracy.
Boltzmann exploration is widely used in reinforcement learning to provide a trade-off between exploration and exploitation. Recently, in (Cesa-Bianchi et al., 2017) it has been shown that pure Boltzmann exploration does not perform well from a regret perspective, even in the simplest setting of stochastic multi-armed b…
In this paper, we build on the biquasiles and dual graph diagrams introduced in arXiv:1610.06969. We introduce \textit{biquasile Boltzmann weights} that enhance the previous knot coloring invariant defined in terms of finite biquasiles and provide examples differentiating links with the same counting invariant, demonst…
A Gaussian restricted Boltzmann machine (GRBM) is a Boltzmann machine defined on a bipartite graph and is an extension of usual restricted Boltzmann machines. A GRBM consists of two different layers: a visible layer composed of continuous visible variables and a hidden layer composed of discrete hidden variables. In th…
In this work an iterative algorithm based on unsupervised learning is presented, specifically on a Restricted Boltzmann Machine (RBM) to solve a perfect matching problem on a bipartite weighted graph. Iteratively is calculated the weights and the bias parameters that maximize the energy funct…
New method generates molecular conformations efficiently.
The restricted Boltzmann machine is a graphical model for binary random variables. Based on a complete bipartite graph separating hidden and observed variables, it is the binary analog to the factor analysis model. We study this graphical model from the perspectives of algebraic statistics and tropical geometry, starti…
The paper develops a new algorithm for RBMs using dynamical mean-field theory.
We introduce colorings of oriented surface-links by biquasiles using marked graph diagrams. We use these colorings to define counting invariants and Boltzmann enhancements of the biquasile counting invariants for oriented surface-links. We provide examples to show that the invariants can distinguish both closed surface…
Transferable Boltzmann Generators learn to sample unseen molecules efficiently.
D-Wave computers struggle with sampling Boltzmann distributions efficiently.
We present transductive Boltzmann machines (TBMs), which firstly achieve transductive learning of the Gibbs distribution. While exact learning of the Gibbs distribution is impossible by the family of existing Boltzmann machines due to combinatorial explosion of the sample space, TBMs overcome the problem by adaptively …
Quantum Boltzmann Machines trained on quantum annealers produce noisy synthetic data.
The probability density function for the visible sector of a Riemann-Theta Boltzmann machine can be taken conditional on a subset of the visible units. We derive that the corresponding conditional density function is given by a reparameterization of the Riemann-Theta Boltzmann machine modelling the original probability…
We introduce a new method for training deep Boltzmann machines jointly. Prior methods require an initial learning pass that trains the deep Boltzmann machine greedily, one layer at a time, or do not perform well on classifi- cation tasks.
RBM and DBM are represented as 2D tensor networks, revealing their expressive power and efficiency.
A new method speeds up sampling of Boltzmann distribution in high-dimensional systems.
We show that deep narrow Boltzmann machines are universal approximators of probability distributions on the activities of their visible units, provided they have sufficiently many hidden layers, each containing the same number of units as the visible layer. We show that, within certain parameter domains, deep Boltzmann…
A new machine learning model uses score matching to estimate probability densities efficiently.
Neural Boltzmann Machines improve on CRBMs for modeling data.
This paper provides a tutorial on Boltzmann Machines and Deep Belief Networks.
We propose a relaxation-based approximate inference algorithm that samples near-MAP configurations of a binary pairwise Markov random field. We experiment on MAP inference tasks in several restricted Boltzmann machines. We also use our underlying sampler to estimate the log-partition function of restricted Boltzmann ma…
CAP-BM learns complex-valued data's amplitude and phase distributions.
In 1870s, L. Boltzmann proved the famous -theorem for the Boltzmann equation in the kinetic theory of gas and gave the statistical interpretation of the thermodynamic entropy. In 2002, G. Perelman introduced the notion of -entropy and proved the -entropy formula for the Ricci flow. This plays a crucial role in…
Quantum machine learns faster by reverse annealing on AQCs.
Boltzmann machines are physics informed generative models with wide applications in machine learning. They can learn the probability distribution from an input dataset and generate new samples accordingly. Applying them back to physics, the Boltzmann machines are ideal recommender systems to accelerate Monte Carlo simu…
Boltzmann machines are powerful distributions that have been shown to be an effective prior over binary latent variables in variational autoencoders (VAEs). However, previous methods for training discrete VAEs have used the evidence lower bound and not the tighter importance-weighted bound. We propose two approaches fo…
A new sampler and temperature estimation method enable efficient learning of Boltzmann Machines.
EDG generates Boltzmann samples from latent variables efficiently.
BNEM improves Boltzmann sampler efficiency.
Inverse problem solved for relativistic Boltzmann equation on spacetime.
We propose a method for solving statistical mechanics problems defined on sparse graphs. It extracts a small Feedback Vertex Set (FVS) from the sparse graph, converting the sparse system to a much smaller system with many-body and dense interactions with an effective energy on every configuration of the FVS, then learn…
Since learning is typically very slow in Boltzmann machines, there is a need to restrict connections within hidden layers. However, the resulting states of hidden units exhibit statistical dependencies. Based on this observation, we propose using regularization upon the activation possibilities of hidden unit…
We propose an expectation-maximization-like(EMlike) method to train Boltzmann machine with unconstrained connectivity. It adopts Monte Carlo approximation in the E-step, and replaces the intractable likelihood objective with efficiently computed objectives or directly approximates the gradient of likelihood objective i…
Statistical models of economic distributions lead to Boltzmann distributions rather than a Pareto power law. This result is supported by two facts: 1. the distributions of income, car sales, marriages or jobs are a matter of chances and luck and not of reason! 2. Data for property, automobile sales, marriages and job m…
CG-BGs combine flow-based models with PMFs to sample large systems efficiently.
Value function estimation is an important task in reinforcement learning, i.e., prediction. The Boltzmann softmax operator is a natural value estimator and can provide several benefits. However, it does not satisfy the non-expansion property, and its direct use may fail to converge even in value iteration. In this pape…
Learning in restricted Boltzmann machine is typically hard due to the computation of gradients of log-likelihood function. To describe the network state statistics of the restricted Boltzmann machine, we develop an advanced mean field theory based on the Bethe approximation. Our theory provides an efficient message pas…
The restricted Boltzmann machine is a network of stochastic units with undirected interactions between pairs of visible and hidden units. This model was popularized as a building block of deep learning architectures and has continued to play an important role in applied and theoretical machine learning. Restricted Bolt…
Near-Exponential Convergence Rates for kNN Classification
The Boltzmann machine provides a useful framework to learn highly complex, multimodal and multiscale data distributions that occur in the real world. The default method to learn its parameters consists of minimizing the Kullback-Leibler (KL) divergence from training samples to the Boltzmann model. We propose in this wo…
We propose a method to decrease the number of hidden units of the restricted Boltzmann machine while avoiding decrease of the performance measured by the Kullback-Leibler divergence. Then, we demonstrate our algorithm by using numerical simulations.
This work introduces a novel nonparametric density index defined on graphs, the Sum-over-Forests (SoF) density index. It is based on a clear and intuitive idea: high-density regions in a graph are characterized by the fact that they contain a large amount of low-cost trees with high outdegrees while low-density regions…
In emissions trading, the initial allocation of permits is an intractable issue because it needs to be essentially fair to the participating countries. There are many ways to distribute a given total amount of emissions permits among countries, but the existing distribution methods, such as auctioning and grandfatherin…
New algorithm for learning RBMs with sparse latent variables.
New geometric perspective for optimal learning on hexagonal structures.