Communication: Multiple atomistic force fields in a single enhanced sampling simulation | Zendy

Viet Hoang Man | Zendy; Philippe Derreumaux | Zendy; Phuong H. Nguyen | Zendy

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Communication: Multiple atomistic force fields in a single enhanced sampling simulation

Author(s) -

Viet Hoang Man,

Philippe Derreumaux,

Phuong H. Nguyen

Publication year - 2015

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 - 10.1063/1.4926535

Subject(s) - force field (fiction) , replica , molecular dynamics , umbrella sampling , sampling (signal processing) , tempering , statistical physics , computer science , parallel tempering , convergence (economics) , energy landscape , random walk , physics , computational chemistry , chemistry , materials science , mathematics , artificial intelligence , telecommunications , art , economic growth , bayesian probability , monte carlo molecular modeling , composite material , visual arts , markov chain monte carlo , thermodynamics , statistics , economics , detector

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