R.E.D. Server: A web service for deriving RESP and ESP charges and building force field libraries for new molecules and molecular fragments

Nucleic Acids Research

Volumn 39, Issue SUPPL. 2, 2011, Pages

  Vanquelef, Enguerran ^a   Simon, Sabrina ^a   Marquant, Gaelle ^a   Garcia, Elodie ^a   Klimerak, Geoffroy ^a   Delepine, Jean Charles ^a   Cieplak, Piotr ^b   Dupradeau, François Yves ^a  

^a UNIVERSITÉ DE PICARDIE JULES VERNE   (France)

^b BURNHAM INSTITUTE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALIXARENE;

ARTICLE; ATOM; COMPUTER GRAPHICS; COMPUTER INTERFACE; COMPUTER PROGRAM; COMPUTER SYSTEM; DATA BASE; ELECTRIC FIELD; ELECTRICITY; ELECTROSTATIC POTENTIAL; FORCE FIELD; MOLECULAR DYNAMICS; PRIORITY JOURNAL; QUANTUM MECHANICS; RESTRAINED ELECTROSTATIC POTENTIAL;

CALIXARENES; INTERNET; MOLECULAR DYNAMICS SIMULATION; QUANTUM THEORY; SOFTWARE; STATIC ELECTRICITY; USER-COMPUTER INTERFACE;

EID: 79959999377     PISSN: 03051048     EISSN: 13624962     Source Type: Journal    
DOI: 10.1093/nar/gkr288     Document Type: Article

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