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Volumn 99, Issue 8, 2001, Pages 627-636

Statistical thermodynamics of hindered rotation from computer simulations

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; ENTROPY; HAMILTONIANS; MOLECULAR DYNAMICS; MOLECULAR ORIENTATION; NUMERICAL ANALYSIS; STATISTICAL METHODS; THERMODYNAMIC PROPERTIES;

EID: 0035918348     PISSN: 00268976     EISSN: None     Source Type: Journal    
DOI: 10.1080/00268970010024353     Document Type: Article
Times cited : (13)

References (46)
  • 12
    • 0032342086 scopus 로고    scopus 로고
    • edited by K. B. Lipkowitz and D. B. Boyd (New York: Wiley)
    • Meirovitch, H., 1998, Reviews in Computational Chemistry, Vol. 12, edited by K. B. Lipkowitz and D. B. Boyd (New York: Wiley), pp. 1-74.
    • (1998) Reviews in Computational Chemistry , vol.12 , pp. 1-74
    • Meirovitch, H.1
  • 28
    • 0004249259 scopus 로고
    • revised by K. S. Pitzer and L. Brewer (New York: McGraw-Hill)
    • Lewis, N., and Randall, M., 1961, Thermodynamics, 2nd Edn, revised by K. S. Pitzer and L. Brewer (New York: McGraw-Hill).
    • (1961) Thermodynamics, 2nd Edn
    • Lewis, N.1    Randall, M.2
  • 29
    • 0011011984 scopus 로고    scopus 로고
    • edited by P. V. R. Schleyer, N. L. Allinger, T. Clark, J. Gasteiger, P. A. Kollman, H. F. Schaefer III and P. R. Schreiner (Chichester: Wiley)
    • MacKerell Jr, A. D., 1998, Encyclopedia of Computational Chemistry, edited by P. V. R. Schleyer, N. L. Allinger, T. Clark, J. Gasteiger, P. A. Kollman, H. F. Schaefer III and P. R. Schreiner (Chichester: Wiley), pp. 2191-2200.
    • (1998) Encyclopedia of Computational Chemistry , pp. 2191-2200
    • Mackerell, A.D.1
  • 41
    • 0011036417 scopus 로고    scopus 로고
    • Rapidly convergent method for Boltzmann-weighted ensemble generation in free energy simulations
    • Still, W. C., Guarnieri, F., and Senderowitz, H., 1998, Rapidly convergent method for Boltzmann-weighted ensemble generation in free energy simulations, US Patent #574 007 2.
    • (1998) US Patent #574 007 2
    • Still, W.C.1    Guarnieri, F.2    Senderowitz, H.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.