FragIt: A Tool to Prepare Input Files for Fragment Based Quantum Chemical Calculations

PLoS ONE

Volumn 7, Issue 9, 2012, Pages

  Steinmann, Casper ^a   Ibsen, Mikael W ^a   Hansen, Anne S ^a   Jensen, Jan H ^a  

^a UNIVERSITY OF COPENHAGEN   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

CARBOHYDRATE DERIVATIVE; CYCLODEXTRIN; DNA; GALACTOPYRANOSE; POLYSACCHARIDE; PROTEIN; UNCLASSIFIED DRUG;

ARTICLE; COMPUTER INTERFACE; COMPUTER LANGUAGE; COMPUTER PROGRAM; FRAGMENTATION REACTION; INFORMATION PROCESSING; METHODOLOGY; QUANTUM CHEMISTRY;

ALGORITHMS; DNA; MODELS, CHEMICAL; POLYMERS; POLYSACCHARIDES; PROTEINS; SOFTWARE;

EID: 84866512069     PISSN: None     EISSN: 19326203     Source Type: Journal    
DOI: 10.1371/journal.pone.0044480     Document Type: Article

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