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Volumn 100, Issue 20, 1996, Pages 8224-8229

Conformations of 1,2-dimethoxyethane in gas and solution phase from molecular mechanics and Monte Carlo/stochastic dynamics simulations

Author keywords

[No Author keywords available]

Indexed keywords

MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; MONTE CARLO METHODS; SIMULATION;

EID: 0030134511     PISSN: 00223654     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp952581y     Document Type: Article
Times cited : (36)

References (24)
  • 16
    • 84986439485 scopus 로고
    • Amber* and OPLS* are MacroModel implementations of the respective force fields. Amber* uses the more recent 6,12 Lennard Jones treatment for hydrogen bonding (J. Comput. Chem. 1991, 12, 620).
    • (1991) J. Comput. Chem. , vol.12 , pp. 620
  • 19
    • 33748565161 scopus 로고
    • Original torsional parameters taken from Billeter, et al. J. Am. Chem. Soc. 1988, 110, 9620.
    • (1988) J. Am. Chem. Soc. , vol.110 , pp. 9620
    • Billeter1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.