Gabedita - A graphical user interface for computational chemistry softwares

Journal of Computational Chemistry

Volumn 32, Issue 1, 2011, Pages 174-182

  Allouche, Abdul Rahman ^a,b,c  

^a UNIVERSITÉ DE LYON   (France)

^b UNIVERSITÉ LYON 1   (France)

^c University of Lyon   (France)

Author keywords

animation; charge distribution; computational chemistry softwares; electrostatic potential; GUI; molecular density; visualization

Indexed keywords

ATOMS IN MOLECULES; COMPUTATIONAL CHEMISTRY SOFTWARE; COMPUTATIONAL CHEMISTRY SOFTWARES; CONFORMATIONAL SEARCH; ELECTRON DENSITIES; ELECTRONIC CIRCULAR DICHROISM; ELECTROSTATIC POTENTIAL; ELECTROSTATIC POTENTIALS; GUI; INPUT FILES; MOLECULAR DENSITY; MOLECULAR PROPERTIES; MOLECULAR SYSTEMS; MULTIGRID METHODS; NUCLEAR MAGNETIC RESONANCE SHIELDING; OPEN SOURCES; PARTIAL CHARGES; PLATFORM INDEPENDENT; QUANTUM MECHANICAL; SEMI-EMPIRICAL; UV-VISIBLE; VECTOR GRAPHICS; VOLUMETRIC DATA;

ANIMATION; CHARGE DISTRIBUTION; CHARGED PARTICLES; CHEMICAL BONDS; DICHROISM; ELECTROSTATICS; GRAPHICAL USER INTERFACES; MAGNETIC RESONANCE; MOLECULAR ORBITALS; POISSON EQUATION; QUANTUM THEORY; VISUALIZATION; VOLUMETRIC ANALYSIS;

COMPUTATIONAL CHEMISTRY;

EID: 78449275560     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.21600     Document Type: Article

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