default search action
BibTeX records: Yipin Lu
@article{DBLP:journals/jcisd/LuASGKSRNLJ19, author = {Yipin Lu and Shankara Anand and William A. Shirley and Peter Gedeck and Brian P. Kelley and Suzanne Skolnik and Stephane Rodde and Mai Nguyen and Mika K. Lindvall and Weiping Jia}, title = {Prediction of pKa Using Machine Learning Methods with Rooted Topological Torsion Fingerprints: Application to Aliphatic Amines}, journal = {J. Chem. Inf. Model.}, volume = {59}, number = {11}, pages = {4706--4719}, year = {2019}, url = {https://doi.org/10.1021/acs.jcim.9b00498}, doi = {10.1021/ACS.JCIM.9B00498}, timestamp = {Tue, 01 Jun 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/LuASGKSRNLJ19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/GedeckLSRDJBVFL15, author = {Peter Gedeck and Yipin Lu and Suzanne Skolnik and Stephane Rodde and Gavin Dollinger and Weiping Jia and Giuliano Berellini and Riccardo Vianello and Bernard Faller and Franco Lombardo}, title = {Benefit of Retraining p\emph{K}\({}_{\mbox{a}}\) Models Studied Using Internally Measured Data}, journal = {J. Chem. Inf. Model.}, volume = {55}, number = {7}, pages = {1449--1459}, year = {2015}, url = {https://doi.org/10.1021/acs.jcim.5b00172}, doi = {10.1021/ACS.JCIM.5B00172}, timestamp = {Fri, 06 Mar 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcisd/GedeckLSRDJBVFL15.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/LuWYW07, author = {Yipin Lu and Renxiao Wang and Chao{-}Yie Yang and Shaomeng Wang}, title = {Analysis of Ligand-Bound Water Molecules in High-Resolution Crystal Structures of Protein-Ligand Complexes}, journal = {J. Chem. Inf. Model.}, volume = {47}, number = {2}, pages = {668--675}, year = {2007}, url = {https://doi.org/10.1021/ci6003527}, doi = {10.1021/CI6003527}, timestamp = {Mon, 26 Jun 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/LuWYW07.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/WangLFW04, author = {Renxiao Wang and Yipin Lu and Xueliang Fang and Shaomeng Wang}, title = {An Extensive Test of 14 Scoring Functions Using the PDBbind Refined Set of 800 Protein-Ligand Complexes}, journal = {J. Chem. Inf. Model.}, volume = {44}, number = {6}, pages = {2114--2125}, year = {2004}, url = {https://doi.org/10.1021/ci049733j}, doi = {10.1021/CI049733J}, timestamp = {Mon, 26 Jun 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/WangLFW04.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
manage site settings
To protect your privacy, all features that rely on external API calls from your browser are turned off by default. You need to opt-in for them to become active. All settings here will be stored as cookies with your web browser. For more information see our F.A.Q.