Citations
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ZINC
To cite ZINC, please reference: Irwin, Sterling, Mysinger, Bolstad and Coleman, J. Chem. Inf. Model. 2012, accepted for publication. | DOI: 10.1021/ci3001277 To cite the original ZINC paper, please reference: Irwin and Shoichet, J. Chem. Inf. Model. 2005;45(1):177-82 PDF, DOI. We thank NIGMS for financial support (GM71896).
DOCK 6
Lang PT, Brozell SR, Mukherjee S, Pettersen EF, Meng EC, Thomas V, Rizzo RC, Case DA, James TL, Kuntz ID. DOCK 6: combining techniques to model RNA-small molecule complexes. RNA. 2009 Jun;15(6):1219-30. Epub 2009 Apr 15.
DOCK 3.6
Lorber DM, Shoichet BK., Hierarchical docking of databases of multiple ligand conformations. Curr Top Med Chem. 2005;5(8):739-49.
and
Lorber DM, Shoichet BK., Flexible ligand docking using conformational ensembles. Protein Sci. 1998 Apr;7(4):938-50.
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Molinspiration
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