posted Mar 21, 2017, 9:40 AM by Gerard JP van Westen
36 Data-driven approaches used for compound library design, hit triage and bioactivity modeling in high-throughput screening Brief Bioinform (2016), bbw105, doi: https://doi.org/10.1093/bib/bbw105 Shardul Paricharak, Oscar Méndez-Lucio, Aakash Chavan Ravindranath, Andreas Bender, Adriaan P. IJzerman, and Gerard J. P. van Westen
| 35 Interacting with GPCRs: Using Interaction Fingerprints for Virtual Screening JCIM (2016), 56, 10, doi: 10.1021/acs.jcim.6b00314 Eelke B. Lenselink, Willem Jespers, Herman W. T. van Vlijmen, Adriaan P. IJzerman, and Gerard J. P. van Westen
| 34 Unprecedently Large-Scale Kinase Inhibitor Set Enabling the Accurate Prediction of Compound–Kinase Activities: A Way toward Selective Promiscuity by Design? JCIM (2016), 56, 9, doi: 10.1021/acs.jcim.6b00122 Serge Christmann-Franck, Gerard J. P. van Westen, George Papadatos, Fanny Beltran Escudie, Alexander Roberts, John P. Overington, and Daniel Domine
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