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Development of novel statistical potentials describing cation-pi interactions in proteins and comparison with semiempirical and quantum chemistry approaches

par Gilis, Dimitri ;Biot, Christophe ;Buisine, Eric;Dehouck, Yves ;Rooman, Marianne
Référence Journal of chemical information and modeling, 46, 2, page (884-893)
Publication Publié, 2006

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Titre:	Development of novel statistical potentials describing cation-pi interactions in proteins and comparison with semiempirical and quantum chemistry approaches
Auteur:	Gilis, Dimitri; Biot, Christophe; Buisine, Eric; Dehouck, Yves; Rooman, Marianne
Informations sur la publication:	Journal of chemical information and modeling, 46, 2, page (884-893)
Statut de publication:	Publié, 2006
Sujet CREF:	Sciences bio-médicales et agricoles
MeSH keywords:	Algorithms
	Cations -- chemistry
	Databases as Topic
	Protein Binding
	Protein Structure, Tertiary
	Proteins -- chemistry
	Quantum Theory
Note générale:	Comparative Study
	Journal Article
	Research Support, Non-U.S. Gov't
Langue:	Anglais
Identificateurs:	urn:issn:1549-9596
	info:doi/10.1021/ci050395b
	info:scp/33646236303
	info:pmid/16563020