Joint neighbors approximation of macromolecular solvent accessible surface area

Journal of Computational Chemistry

Volumn 28, Issue 12, 2007, Pages 1974-1989

  Rychkov, Georgy ^a,b   Petukhov, Michael ^a  

^a PETERSBURG NUCLEAR PHYSICS INSTITUTE   (Russian Federation)

^b PETER THE GREAT ST PETERSBURG POLYTECHNIC UNIVERSITY   (Russian Federation)

Author keywords

Analytical gradients; Analytical surface area; Folded and unfolded proteins; Hydration; Solvent accessible surface area

Indexed keywords

APPROXIMATION THEORY; CONFORMATIONS; HYDRATION; MACROMOLECULES; PROTEIN FOLDING;

ANALYTICAL GRADIENTS; ANALYTICAL SURFACE AREA; FOLDED AND UNFOLDED PROTEINS; SOLVENT-ACCESSIBLE SURFACE AREA;

SOLVENTS;

MACROCYCLIC COMPOUND; SOLVENT;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; SURFACE PROPERTY;

MACROCYCLIC COMPOUNDS; MOLECULAR STRUCTURE; SOLVENTS; SURFACE PROPERTIES;

EID: 34547336672     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20550     Document Type: Article

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