Development of molecular simulation methods to accurately represent protein-surface interactions: The effect of pressure and its determination for a system with constrained atoms

Biointerphases

Volumn 5, Issue 3, 2010, Pages 85-95

  Yancey, Jeremy A ^a   Vellore, Nadeem A ^a   Collier, Galen ^a   Stuart, Steven J ^b   Latour, Robert A ^a  

^a Clemson University   (United States)

^b CLEMSON UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; APPLICATION PROGRAMS; CALIBRATION; FREE ENERGY; HYDROPHOBICITY; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; PEPTIDES; SURFACE CHEMISTRY;

ADSORPTION BEHAVIOR; FREE ENERGY OF ADSORPTION; HYDROPHOBIC SURFACES; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SIMULATIONS; PRESSURE CALIBRATION; PROTEIN-SURFACE INTERACTIONS; UNCONSTRAINED SYSTEMS;

ATOMS;

EID: 78650843481     PISSN: 19348630     EISSN: 15594106     Source Type: Journal    
DOI: 10.1116/1.3493470     Document Type: Article

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