2017_03_21 3 new publications added

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