An automatic method to generate force-field parameters for hetero-compounds

Acta Crystallographica - Section D Biological Crystallography

Volumn 59, Issue 2, 2003, Pages 274-289

  Nilsson, Kristina ^a   Lecerof, David ^a   Sigfridsson, Emma ^a   Ryde, Ulf ^a  

^a LUND UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

2 FLUOROETHANOL; 2-FLUOROETHANOL; 5' DEOXYADENOSINE; 5'-DEOXYADENOSINE; ALCOHOL; DEOXYADENOSINE DERIVATIVE; DRUG DERIVATIVE; ENZYME; HEME; MESOPORPHYRIN; ZINC;

ALGORITHM; ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPARATIVE STUDY; COMPUTER PROGRAM; METABOLISM; METHODOLOGY; PROTEIN CONFORMATION; REPRODUCIBILITY; X RAY CRYSTALLOGRAPHY;

ALGORITHMS; CRYSTALLOGRAPHY, X-RAY; DEOXYADENOSINES; ENZYMES; ETHANOL; HEME; MESOPORPHYRINS; MODELS, MOLECULAR; PROTEIN CONFORMATION; REPRODUCIBILITY OF RESULTS; SOFTWARE; ZINC;

EID: 0242432554     PISSN: 09074449     EISSN: None     Source Type: Journal    
DOI: 10.1107/S0907444902021431     Document Type: Article

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