Hamiltonian replica exchange in GROMACS: A flexible implementation

Molecular Physics

Volumn 112, Issue 3-4, 2014, Pages 379-384

  Bussi, Giovanni ^a  

^a SISSA   (Italy)

Author keywords

Hamiltonian replica exchange; RNA tetraloop; Solute tempering

Indexed keywords

ALANINE DIPEPTIDES; GROMACS; PERFORMANCE PENALTIES; REPLICA EXCHANGE; TOY MODELS;

AMINO ACIDS; MOLECULAR DYNAMICS; RNA;

HAMILTONIANS;

EID: 84893852130     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268976.2013.824126     Document Type: Conference Paper

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