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Volumn 26, Issue 3, 2005, Pages 283-293

Development of a multipoint model for sulfur in proteins: A new parametrization scheme to reproduce high-level ab initio interaction energies

Author keywords

Force field parameters; Hydrogen bonds to sulfur; MP2; Potential energy surface

Indexed keywords

COMPUTER SIMULATION; CRYSTAL STRUCTURE; HYDROGEN BONDS; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; PARAMETER ESTIMATION; POTENTIAL ENERGY; QUANTUM THEORY; STABILITY;

EID: 13444311955     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.20163     Document Type: Article
Times cited : (13)

References (29)


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.