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Journal of Computer-Aided Molecular Design|August 3, 2005
Model of full-length HIV-1 integrase complexed with viral DNA as template for anti-HIV drug designRajeshri G Karki, Yun Tang, Terrence R Burke, et al.Journal of Chemical Information and Modeling|April 14, 2022
Exploration of Ultralarge Compound Collections for Drug DiscoveryWendy A Warr, Marc C Nicklaus, Christos A Nicolaou, et al.Journal of Chemical Information and Modeling|January 24, 2014
A new approach to radial basis function approximation and its application to QSARAlexey V Zakharov, Megan L Peach, Markus Sitzmann, et al.Journal of Chemical Information and Modeling|February 15, 2014
QSAR modeling of imbalanced high-throughput screening data in PubChemAlexey V Zakharov, Megan L Peach, Markus Sitzmann, et al.Future Medicinal Chemistry|March 24, 2011
Authentic HIV-1 integrase inhibitorsChenzhong Liao, Christophe Marchand, Terrence R Burke, et al.Bioorganic & Medicinal Chemistry Letters|August 28, 2007
Virtual screening application of a model of full-length HIV-1 integrase complexed with viral DNAChenzhong Liao, Rajeshri G Karki, Christophe Marchand, et al.Journal of Chemical Information and Modeling|February 12, 2020
Toward a Comprehensive Treatment of Tautomerism in Chemoinformatics Including in InChI V2Devendra K Dhaked, Wolf-Dietrich Ihlenfeldt, Hitesh Patel, et al.Scientific Data|June 23, 2025
SAVI Space-combinatorial encoding of the billion-size synthetically accessible virtual inventoryMalte Korn, Philip Judson, Raphael Klein, et al.Bioorganic & Medicinal Chemistry Letters|November 25, 2010
Discovery of a novel hybrid from finasteride and epristeride as 5α-reductase inhibitorZhiyi Yao, Yingjun Xu, Minmin Zhang, et al.Journal of Chemical Information and Computer Sciences|February 22, 2002
Enhanced CACTVS browser of the Open NCI DatabaseWolf-Dietrich Ihlenfeldt, Johannes H Voigt, Bruno Bienfait, et al.Pageof 10