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Journal of Molecular Structure: THEOCHEM

Volumn 581, Issue 1-3, 2002, Pages 167-175

A QM/MM approach with effective fragment potentials applied to the dipeptide-water structures

(5) Nemukhin, Alexander V a Grigorenko, Bella L a Bochenkova, Anastassia V a Topol, Igor A b Burt, Stanley K b

a MOSCOW STATE UNIVERSITY (Russian Federation)

b SAIC FREDERICK INC (United States)

Author keywords

Dipeptide water structures; Effective fragment potentials; QM MM method

Indexed keywords

DIPEPTIDE; PEPTIDE FRAGMENT; WATER;

ACCURACY; ANALYTIC METHOD; ARTICLE; CHEMICAL STRUCTURE; COMPLEX FORMATION; COMPUTER ANALYSIS; COMPUTER PROGRAM; FORCE; HYDROGEN BOND; MOLECULAR INTERACTION; MOLECULAR MECHANICS; MOLECULAR MODEL; PROTEIN CONFORMATION; QUANTUM MECHANICS; REACTION ANALYSIS; STRUCTURE ANALYSIS;

EID: 0037023160 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(01)00755-2 Document Type: Article

Times cited : (41)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.