Open AccessMolecular Dynamics Simulations of Adsorption of Amino Acid Side Chain Analogues and a Titanium Binding Peptide on the TiO2 (100) Surface
Author(s) -
Erik G. Brandt,
Alexander P. Lyubartsev
Publication year - 2015
Publication title -
the journal of physical chemistry c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.401
H-Index - 289
eISSN - 1932-7455
pISSN - 1932-7447
DOI - 10.1021/acs.jpcc.5b02670
Subject(s) - peptide , metadynamics , adsorption , side chain , molecular dynamics , chemistry , umbrella sampling , salt bridge , binding energy , hydrogen bond , crystallography , amino acid , surface energy , molecule , computational chemistry , organic chemistry , biochemistry , nuclear physics , gene , polymer , physics , mutant
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