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Machine learning transforms how microstates are sampled.

Authors :
Tuckerman, Mark E.
Source :
Science. 9/6/2019, Vol. 365 Issue 6457, p982-983. 2p. 2 Color Photographs, 1 Diagram, 1 Graph.
Publication Year :
2019

Abstract

A review is presented of the article "Boltzmann generators: Sampling equilibrium states of many-body systems with deep learning" by Frank Noé, Jonas Köhler and others on the use of a machine learning methodology to address a problem with atomistic simulations of complex molecular systems using Boltzmann probability distributions to predict equilibrium properties.

Details

Language :
English
ISSN :
00368075
Volume :
365
Issue :
6457
Database :
Academic Search Index
Journal :
Science
Publication Type :
Academic Journal
Accession number :
138487799
Full Text :
https://doi.org/10.1126/science.aay2568