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Robert J. Doerksen
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2020 – today
- 2023
- [j12]Priyanka Samanta
, Robert J. Doerksen
Identifying FmlH lectin-binding small molecules for the prevention of Escherichia coli-induced urinary tract infections using hybrid fragment-based design and molecular docking. Comput. Biol. Medicine 163: 107072 (2023) - [j11]Reem A. Alkhodier
Comparison of Conformational Analyses of Naturally Occurring Flavonoid-O-Glycosides with Unnatural Flavonoid-CF2-Glycosides Using Molecular Modeling. J. Chem. Inf. Model. 63(1): 375-386 (2023)
2010 – 2019
- 2019
- [j10]Jonathan D. Wren, Robert J. Doerksen
Proceedings of the 2018 MidSouth Computational Biology and Bioinformatics Society (MCBIOS) conference. BMC Bioinform. 20-S(2): 95:1-95:5 (2019) - 2013
- [j9]Zhendong Zhao, Gang Fu, Sheng Liu, Khaled M. Elokely
Drug activity prediction using multiple-instance learning via joint instance and feature selection. BMC Bioinform. 14(S-14): S16 (2013) - [j8]Khaled M. Elokely
Docking Challenge: Protein Sampling and Molecular Docking Performance. J. Chem. Inf. Model. 53(8): 1934-1945 (2013) - 2012
- [j7]Gang Fu, Xiaofei Nan, Haining Liu, Ronak Y. Patel, Pankaj R. Daga
Implementation of multiple-instance learning in drug activity prediction. BMC Bioinform. 13(S-15): S3 (2012) - 2011
- [j6]Xiaofei Nan, Gang Fu, Zhengdong Zhao, Sheng Liu, Ronak Y. Patel, Haining Liu, Pankaj R. Daga
Leveraging domain information to restructure biological prediction. BMC Bioinform. 12(S-10): S22 (2011) - [c1]Sheng Liu, Ronak Y. Patel, Pankaj R. Daga
Multi-class Joint Rule Extraction and Feature Selection for Biological Data. BIBM 2011: 476-481
2000 – 2009
- 2009
- [j5]Sivaprakasam Prasanna, Pankaj R. Daga
Glycogen synthase kinase-3 inhibition by 3-anilino-4-phenylmaleimides: insights from 3D-QSAR and docking. J. Comput. Aided Mol. Des. 23(2): 113-127 (2009) - [j4]Aihua Xie, Srinivas Odde, Sivaprakasam Prasanna, Robert J. Doerksen
Imidazole-containing farnesyltransferase inhibitors: 3D quantitative structure-activity relationships and molecular docking. J. Comput. Aided Mol. Des. 23(7): 431-448 (2009) - [j3]Sivaprakasam Prasanna, Perrer N. Tosso, Robert J. Doerksen
Structure-Activity Relationship and Comparative Docking Studies for Cycloguanil Analogs as PfDHFR-TS Inhibitors. J. Chem. Inf. Model. 49(7): 1787-1796 (2009) - 2008
- [j2]Pankaj R. Daga
Stereoelectronic properties of spiroquinazolinones in differential PDE7 inhibitory activity. J. Comput. Chem. 29(12): 1945-1954 (2008) - 2004
- [j1]Robert J. Doerksen, Valerie J. Steeves, Ajit J. Thakkar:
Are polarizabilities useful as aromaticity indices? Tests on azines, azoles, oxazoles and thiazoles. J. Comput. Methods Sci. Eng. 4(3): 427-438 (2004)
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