Open Access<span>Enhancing protonation sampling via a pHRE replica exchange scheme</span>
Author(s) -
Diogo VilaViçosa,
Pedro B. P. S. Reis,
Chris Oostenbrink,
Miguel Machuqueiro
Publication year - 2017
Language(s) - Uncategorized
Resource type - Conference proceedings
DOI - 10.3390/mol2net-03-05081
Subject(s) - protonation , biomolecule , chemistry , titration , membrane , molecule , replica , computational chemistry , context (archaeology) , molecular dynamics , biological system , chemical physics , organic chemistry , ion , biochemistry , art , visual arts , biology , paleontology
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