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Machine learning based implicit solvent model for aqueous-solution alanine dipeptide molecular dynamics simulations.

Authors :
Yao, Songyuan
Van, Richard
Pan, Xiaoliang
Park, Ji Hwan
Mao, Yuezhi
Pu, Jingzhi
Mei, Ye
Shao, Yihan
Source :
RSC Advances; 2023, Vol. 13 Issue 7, p4565-4577, 13p
Publication Year :
2023

Details

Language :
English
ISSN :
20462069
Volume :
13
Issue :
7
Database :
Complementary Index
Journal :
RSC Advances
Publication Type :
Academic Journal
Accession number :
161741117
Full Text :
https://doi.org/10.1039/d2ra08180f