Molecular Latent Space Simulators for Distributed and Multimolecular Trajectories-Reference-Cited by-同舟云学术

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Molecular Latent Space Simulators for Distributed and Multimolecular Trajectories

Published:2023-06-14 Issue:25 Volume:127 Page:5470-5490
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Jones Michael S.¹,McDargh Zachary A.²,Wiewiora Rafal P.³,Izaguirre Jesus A.²,Xu Huafeng²^ORCID,Ferguson Andrew L.¹^ORCID

Affiliation:

1. Pritzker School of Molecular Engineering, The University of Chicago, 5640 South Ellis Avenue, Chicago, Illinois 60637, United States

2. Roivant Discovery, 151 W 42nd Street, New York, New York 10036, United States

3. Psivant Therapeutics, Boston, Massachusetts 02210, United States

Funder

National Science Foundation

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.3c01362

Reference111 articles.

1. Everything you wanted to know about Markov State Models but were afraid to ask

2. Markov State Models: From an Art to a Science

3. Slow dynamics in protein fluctuations revealed by time-structure based independent component analysis: The case of domain motions

4. Landmark Kernel tICA for Conformational Dynamics

5. Nonlinear discovery of slow molecular modes using state-free reversible VAMPnets

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1. AlphaFold and Protein Folding: Not Dead Yet! The Frontier Is Conformational Ensembles;Annual Review of Biomedical Data Science;2024-08-23

2. A Deep Learning-Driven Sampling Technique to Explore the Phase Space of an RNA Stem-Loop;2024-04-07

3. Machine Learning in Soft Matter: From Simulations to Experiments;Advanced Functional Materials;2024-01-31

4. Artificial Intelligence for Conjugated Polymers;Chemistry of Materials;2024-01-29

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