Deep Learning Protein Conformational Space with Convolutions and Latent Interpolations

Determining the different conformational states of a protein and the transition paths between them is key to fully understanding the relationship between biomolecular structure and function. This can be accomplished by sampling protein conformational space with molecular simulation methodologies. De...

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Bibliographic Details
Main Authors: Venkata K. Ramaswamy, Samuel C. Musson, Chris G. Willcocks, Matteo T. Degiacomi
Format: Article
Language:English
Published: American Physical Society 2021-03-01
Series:Physical Review X
Online Access:http://doi.org/10.1103/PhysRevX.11.011052