An extended molecular mechanics (MM3(96)) force field for benzocrown ethers, calixarenes, and spherands

Journal of Molecular Structure: THEOCHEM

Volumn 417, Issue 1-2, 1997, Pages 19-34

  Hay, Benjamin P ^a   Yang, Linrong ^a   Zhang, Delong ^a   Rustad, Jim R ^a   Wasserman, Evgeny ^a  

^a PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

Author keywords

Calixarene; Crown ether; MM3; Molecular mechanics; Spherand

Indexed keywords

EID: 0347714580     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(96)04960-3     Document Type: Article

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