A new quantum method for electrostatic solvation energy of protein

Journal of Chemical Physics

Volumn 125, Issue 9, 2006, Pages

  Mei, Ye ^a   Ji, Changge ^a   Zhang, John Z H ^a,b  

^a NANJING UNIVERSITY   (China)

^b NEW YORK UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTROSTATICS; MACROMOLECULES; MATHEMATICAL MODELS; NUMERICAL ANALYSIS; POLARIZATION; POLYPEPTIDES; PROTACTINIUM;

CONDUCTORLIKE POLARIZABLE CONTINUUM MODEL (CPCM); ELECTROSTATIC SOLVATION; MOLECULAR FRACTIONATION WITH CONJUGATE CAPS (MFCC); QUANTUM CALCULATIONS;

QUANTUM THEORY;

OLIGOPEPTIDE;

ARTICLE; CHEMISTRY; COMPUTER SIMULATION; ELECTRICITY; PROTEIN SECONDARY STRUCTURE; QUANTUM THEORY; THEORETICAL MODEL;

COMPUTER SIMULATION; ELECTROSTATICS; MODELS, THEORETICAL; OLIGOPEPTIDES; PROTEIN STRUCTURE, SECONDARY; QUANTUM THEORY;

EID: 33748569544     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2345201     Document Type: Article

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