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ORCIDWenbo Yu 0002
Person information
- affiliation: University of Maryland, Department of Pharmaceutical Sciences, School of Pharmacy, Baltimore, MD, USA
Other persons with the same name
- Wenbo Yu — disambiguation page
- Wenbo Yu 0001
![[0000-0001-5946-9565]](https://dblp.uni-trier.de./img/orcid-mark.12x12.png "0000-0001-5946-9565")
— Harbin Institute of Technology, Department of Control Science and Engineering, China
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2010 – 2019
- 2019
[j9]Vincent D. Ustach, Sirish Kaushik Lakkaraju, Sunhwan Jo, Wenbo Yu, Wenjuan Jiang, Alexander D. MacKerell Jr.:
Optimization and Evaluation of Site-Identification by Ligand Competitive Saturation (SILCS) as a Tool for Target-Based Ligand Optimization. J. Chem. Inf. Model. 59(6): 3018-3035 (2019)- 2015
- [j8]Wenbo Yu, Sirish Kaushik Lakkaraju, E. Prabhu Raman, Lei Fang, Alexander D. MacKerell Jr.:
Pharmacophore Modeling Using Site-Identification by Ligand Competitive Saturation (SILCS) with Multiple Probe Molecules. J. Chem. Inf. Model. 55(2): 407-420 (2015) - [j7]Sirish Kaushik Lakkaraju, Wenbo Yu, E. Prabhu Raman, Alena V. Hershfeld, Lei Fang, Deepak Deshpande, Alexander D. MacKerell Jr.:
Mapping Functional Group Free Energy Patterns at Protein Occluded Sites: Nuclear Receptors and G-Protein Coupled Receptors. J. Chem. Inf. Model. 55(3): 700-708 (2015) - 2014
- [j6]Wenbo Yu, Sirish Kaushik Lakkaraju, E. Prabhu Raman, Alexander D. MacKerell Jr.:
Site-Identification by Ligand Competitive Saturation (SILCS) assisted pharmacophore modeling. J. Comput. Aided Mol. Des. 28(5): 491-507 (2014) - 2013
- [j5]E. Prabhu Raman, Wenbo Yu, Sirish Kaushik Lakkaraju, Alexander D. MacKerell Jr.:
Inclusion of Multiple Fragment Types in the Site Identification by Ligand Competitive Saturation (SILCS) Approach. J. Chem. Inf. Model. 53(12): 3384-3398 (2013) - 2012
- [j4]Wenbo Yu, Xibing He, Kenno Vanommeslaeghe, Alexander D. MacKerell Jr.:
Extension of the CHARMM general force field to sulfonyl-containing compounds and its utility in biomolecular simulations. J. Comput. Chem. 33(31): 2451-2468 (2012) - 2011
- [j3]E. Prabhu Raman, Wenbo Yu, Olgun Guvench, Alexander D. MacKerell Jr.:
Reproducing Crystal Binding Modes of Ligand Functional Groups Using Site-Identification by Ligand Competitive Saturation (SILCS) Simulations. J. Chem. Inf. Model. 51(4): 877-896 (2011)
2000 – 2009
- 2009
- [j2]Wenbo Yu, Lei Liang, Zijing Lin, Sanliang Ling, Maciej Haranczyk, Maciej Gutowski:
Comparison of some representative density functional theory and wave function theory methods for the studies of amino acids. J. Comput. Chem. 30(4): 589-600 (2009) - [j1]Wenbo Yu, Xuee Xu, Hongbao Li, Rui Pang, Kun Fang, Zijing Lin:
Extensive conformational searches of 13 representative dipeptides and an efficient method for dipeptide structure determinations based on amino acid conformers. J. Comput. Chem. 30(13): 2105-2121 (2009)
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