A Grid computing-based monte carlo docking simulations approach for computational chiral discrimination

Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)

Volumn 3642 LNAI, Issue , 2005, Pages 446-455

  Choi, Youngjin ^a   Kim, Sung Ryul ^a   Hwang, Suntae ^b   Jeong, Karpjoo ^a  

^a Konkuk University   (South Korea)

^b Kookmin University   (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; COMPUTATIONAL METHODS; DATA HANDLING; MOLECULAR STRUCTURE; PARAMETER ESTIMATION; STEREOCHEMISTRY; TEMPERATURE MEASUREMENT;

CHIRAL DISCRIMINATION; CONFORMATIONAL RIGIDITY; FORCE FIELDS; MC DOCKING SIMULATIONS;

MONTE CARLO METHODS;

EID: 33646013912     PISSN: 03029743     EISSN: 16113349     Source Type: Book Series    
DOI: 10.1007/11548706_47     Document Type: Conference Paper

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