Data-guided Multi-Map variables for ensemble refinement of molecular movies
Author(s) -
John Vant,
Daipayan Sarkar,
Ellen Streitwieser,
Giacomo Fiorin,
Robert D. Skeel,
Josh V. Vermaas,
Abhishek Singharoy
Publication year - 2020
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/5.0022433
Subject(s) - observable , molecular dynamics , statistical physics , resolution (logic) , energy landscape , work (physics) , electron density , computer science , biological system , chemistry , physics , electron , computational chemistry , thermodynamics , artificial intelligence , quantum mechanics , biology
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