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Volumn 62, Issue 17, 1997, Pages 5923-5927

Cyclodextrin Inclusion Complexes. Molecular Mechanics Calculations on the Modification of π-Face Selectivity

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0001599330     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo9614396     Document Type: Article
Times cited : (23)

References (45)
  • 33
    • 1542746029 scopus 로고    scopus 로고
    • MM3(92) program is available from Technical Utilization Corp. Inc., 235 Glen Village Court, Powell, OH 43065
    • MM3(92) program is available from Technical Utilization Corp. Inc., 235 Glen Village Court, Powell, OH 43065.
  • 35
    • 1542640737 scopus 로고    scopus 로고
    • note
    • Except for the type A complex of 1d and 1e in which the reference atom (C5) is initially located at 18 Å from the XY plane placing the closest guest atom as far from the host as to consider no interaction between both molecules.
  • 36
    • 1542431075 scopus 로고    scopus 로고
    • No restraints are considered whith the full matrix minimizer. See MM3 manual
    • No restraints are considered whith the full matrix minimizer. See MM3 manual.
  • 37
    • 1542431074 scopus 로고    scopus 로고
    • Unfortunately, MM3(92) does not allow any other way to consider the solvent effect
    • Unfortunately, MM3(92) does not allow any other way to consider the solvent effect.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.