Charge density and experimental electrostatic potentials of two penicillin derivatives

Chemistry - A European Journal

Volumn 10, Issue 12, 2004, Pages 2977-2982

  Wagner, Armin ^a,c   Flaig, Ralf ^b   Dittrich, Birger ^a   Schmidt, Horst ^d   Koritsánszky, Tibor ^e   Luger, Peter ^a  

^a FREIE UNIVERSITÄT BERLIN   (Germany)

^b INSTITUT DE GÉNÉTIQUE ET DE BIOLOGIE MOLÉCULAIRE ET CELLULAIRE   (France)

^c PAUL SCHERRER INSTITUTE   (Switzerland)

^d UNIVERSITY OF HAMBURG   (Germany)

^e MIDDLE TENNESSEE STATE UNIVERSITY   (United States)

Author keywords

Charge density; Electronic structure; Penicillin; X ray diffraction

Indexed keywords

CHEMICAL BONDS; ELECTROSTATICS; SINGLE CRYSTALS; TOPOLOGY;

CHARGE DENSITY; ELECTROSTATIC POTENTIALS (ESP); PENICILLIN DERIVATIVES;

DERIVATIVES;

PENAMECILLIN; PENAMICILLIN 1 BETA SULFOXIDE; PENICILLIN DERIVATIVE; UNCLASSIFIED DRUG;

ANTIBACTERIAL ACTIVITY; ARTICLE; CHARGE; CHEMICAL BOND; CRYSTAL; DISSOCIATION; DRUG MECHANISM; DRUG STRUCTURE; ELECTRIC POTENTIAL; ELECTRICITY; STRUCTURE ACTIVITY RELATION; STRUCTURE ANALYSIS; SYNCHROTRON; X RAY DIFFRACTION;

ELECTROSTATICS; MODELS, MOLECULAR; PENICILLIN G; STRUCTURE-ACTIVITY RELATIONSHIP; SULFOXIDES; X-RAY DIFFRACTION;

EID: 3042779962     PISSN: 09476539     EISSN: None     Source Type: Journal    
DOI: 10.1002/chem.200305627     Document Type: Article

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