Software news and updates tCONCOORD-GUI: Visually supported conformational sampling of bioactive molecules

Journal of Computational Chemistry

Volumn 30, Issue 7, 2009, Pages 1160-1166

  Seeliger, Daniel ^a   De Groot, Bert L ^a  

^a MAX PLANCK INSTITUTE FOR BIOPHYSICAL CHEMISTRY   (Germany)

Author keywords

CONCOORD; Docking; Induced fit; Molecular dynamics; Protein flexibility; PyMOL; Python; Sampling; SBDD; TCONCOORD

Indexed keywords

CONCOORD; INDUCED FIT; PROTEIN FLEXIBILITY; PYMOL; PYTHON; SBDD; TCONCOORD;

BIOINFORMATICS; CONFORMATIONS; DOCKING; GRAPHICAL USER INTERFACES; HIGH LEVEL LANGUAGES; MOLECULAR DYNAMICS;

DYNAMICS;

PROTEIN;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER INTERFACE; COMPUTER SIMULATION; PROTEIN CONFORMATION; PROTEIN TERTIARY STRUCTURE;

COMPUTER SIMULATION; MODELS, CHEMICAL; MODELS, MOLECULAR; PROTEIN CONFORMATION; PROTEIN STRUCTURE, TERTIARY; PROTEINS; USER-COMPUTER INTERFACE;

EID: 65949087682     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.21127     Document Type: Article

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