Development of modified force field for cation-amino acid interactions: Ab initio-derived empirical correction terms with comments on cation-π interactions

Journal of Computational Chemistry

Volumn 19, Issue 13, 1998, Pages 1515-1525

  Donini, Oreola ^a   Weaver, Donald F ^a  

^a QUEEN S UNIVERSITY   (Canada)

Author keywords

Cation ; CHARMm22.0; Correction term; Development; Force field

Indexed keywords

EID: 0000054601     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(199810)19:13<1515::AID-JCC8>3.0.CO;2-T     Document Type: Article

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