Communications Biology (Jun 2022)

Artificial intelligence guided conformational mining of intrinsically disordered proteins

Aayush Gupta,
Souvik Dey,
Alan Hicks,
Huan-Xiang Zhou

Affiliations

Aayush Gupta: Department of Chemistry, University of Illinois at Chicago
Souvik Dey: Department of Chemistry, University of Illinois at Chicago
Alan Hicks: Department of Chemistry, University of Illinois at Chicago
Huan-Xiang Zhou: Department of Chemistry, University of Illinois at Chicago

DOI: https://doi.org/10.1038/s42003-022-03562-y
Journal volume & issue: Vol. 5, no. 1
pp. 1 – 11

Abstract

Generative autoencoders create full conformational ensembles of intrinsically disordered proteins from short molecular dynamics simulations.

Published in Communications Biology

ISSN: 2399-3642 (Online)
Publisher: Nature Portfolio
Country of publisher: United Kingdom
LCC subjects: Science: Biology (General)
Website: https://www.nature.com/commsbio/

About the journal