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Volumn 108, Issue 13, 1998, Pages 5469-5475

Molecular similarity based on information entropies and distances

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0000350759     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.476316     Document Type: Article
Times cited : (79)

References (50)
  • 2
    • 11744333476 scopus 로고
    • Topics in Current Chemistry Springer-Verlag, Berlin
    • Molecular Similarity I and II, edited by K. D. Sen Vol. 173, 174 of Topics in Current Chemistry (Springer-Verlag, Berlin, 1995).
    • (1995) Molecular Similarity I and II , vol.173-174
    • Sen, K.D.1
  • 14
    • 33746021613 scopus 로고    scopus 로고
    • P. Coppens, J. Phys. Chem. 93, 7979 (1989); P. Coppens, X-ray Charge Densities and Chemical Bonding (Oxford University, New York, 1997).
    • (1989) J. Phys. Chem. , vol.93 , pp. 7979
    • Coppens, P.1
  • 39
    • 85085633513 scopus 로고    scopus 로고
    • note
    • N) of over twenty common organic polyatomic compounds were calculated and all are non-negative. Possibly this is due to the predominant presence of hydrogen and first row atoms where the contribution of ρ(r)1n ρ(r) is mainly negative.
  • 47
    • 11744358344 scopus 로고    scopus 로고
    • Obtianed from R. F. W. Bader, McMaster University, Hamilton, ON, Canada
    • Obtianed from R. F. W. Bader, McMaster University, Hamilton, ON, Canada.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.