How well is conformational space covered?

Chemical Information and Computational Challenges in the 21st Century

Volumn , Issue , 2012, Pages 299-313

  Benkaidali, Lydia ^a,b   Mansouri, Kamel ^c   Tuffery, Pierre ^b   André, François ^a   Petitjean, Michel ^b  

^a CEA   (France)

^b INSERM   (France)

^c HÔPITAL LARIBOISIÈRE   (France)

Author keywords

Clustering conformers; Conformational diversity; DIVCF; ESDM; Extended SDM algorithm; MCG; P450 ligands; SDM; Structural redundancy

Indexed keywords

EID: 84892822357     PISSN: None     EISSN: None     Source Type: Book    
DOI: None     Document Type: Chapter

References (25)

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