Thijs Beuming
Affiliations: | Application Science | Schrodinger |
Area:
Computational ChemistryWebsite:
http://www.schrodinger.comGoogle:
"Thijs Beuming"Mean distance: 9953.25
Parents
Sign in to add mentor| Harel Weinstein | grad student | 2007 | Weill Cornell Medical College | |
| (Structure/function studies of membrane proteins: From molecular modeling and ligand binding to protein -protein interactions of the dopamine transporter.) | ||||
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Publications
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| Cournia Z, Allen BK, Beuming T, et al. (2020) Rigorous Free Energy Simulations in Virtual Screening. Journal of Chemical Information and Modeling |
| Minuesa G, Albanese SK, Xie W, et al. (2019) Small-molecule targeting of MUSASHI RNA-binding activity in acute myeloid leukemia. Nature Communications. 10: 2691 |
| Ghanakota P, Van Vlijmen HWT, Sherman W, et al. (2018) Large Scale Validation of Mixed-Solvent Simulations to Assess Hotspots at PPI Interfaces. Journal of Chemical Information and Modeling |
| Tomasini MD, Wang Y, Karamafrooz A, et al. (2018) Conformational Landscape of the PRKACA-DNAJB1 Chimeric Kinase, the Driver for Fibrolamellar Hepatocellular Carcinoma. Scientific Reports. 8: 720 |
| Tomasini MD, Wang Y, Karamafrooz A, et al. (2018) Abstract 4142: Conformational dynamics of the chimeric kinase DNAJB1-PRKACA, the driver for fibrolamellar hepatocellular carcinoma Cancer Research. 78: 4142-4142 |
| Cappel D, Sherman W, Beuming T. (2017) Calculating Water Thermodynamics in the Binding Site of Proteins - Applications of WaterMap to Drug Discovery. Current Topics in Medicinal Chemistry |
| Bhachoo J, Beuming T. (2017) Investigating Protein-Peptide Interactions Using the Schrödinger Computational Suite. Methods in Molecular Biology (Clifton, N.J.). 1561: 235-254 |
| Lenselink EB, Louvel J, Forti AF, et al. (2016) Predicting Binding Affinities for GPCR Ligands Using Free-Energy Perturbation. Acs Omega. 1: 293-304 |
| Cappel D, Hall ML, Lenselink EB, et al. (2016) Relative Binding Free Energy Calculations Applied to Protein Homology Models. Journal of Chemical Information and Modeling. 56: 2388-2400 |
| Lenselink EB, Beuming T, van Veen C, et al. (2016) In search of novel ligands using a structure-based approach: a case study on the adenosine A2A receptor. Journal of Computer-Aided Molecular Design |