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export results for "Christina de Bruyn Kops"
@phdthesis{DBLP:phd/basesearch/Kops20, author = {Christina de Bruyn Kops}, title = {Development of Computational Approaches for the Prediction of Regioselectivity and the Likely Products of Xenobiotic Metabolism}, school = {University of Hamburg, Germany}, year = {2020}, url = {https://nbn-resolving.org/urn:nbn:de:gbv:18-ediss-90713}, urn = {urn:nbn:de:gbv:18-ediss-90713}, timestamp = {Tue, 05 Mar 2024 00:00:00 +0100}, biburl = {https://dblp.org/rec/phd/basesearch/Kops20.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/bioinformatics/StorkESKCSK20, author = {Conrad Stork and Gerd Embruch and Martin S{\'{\i}}cho and Christina de Bruyn Kops and Ya Chen and Daniel Svozil and Johannes Kirchmair}, title = {{NERDD:} a web portal providing access to in silico tools for drug discovery}, journal = {Bioinform.}, volume = {36}, number = {4}, pages = {1291--1292}, year = {2020}, url = {https://doi.org/10.1093/bioinformatics/btz695}, doi = {10.1093/BIOINFORMATICS/BTZ695}, timestamp = {Wed, 02 Nov 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/bioinformatics/StorkESKCSK20.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/SichoSMKPTVSK19, author = {Martin S{\'{\i}}cho and Conrad Stork and Angelica Mazzolari and Christina de Bruyn Kops and Alessandro Pedretti and Bernard Testa and Giulio Vistoli and Daniel Svozil and Johannes Kirchmair}, title = {{FAME} 3: Predicting the Sites of Metabolism in Synthetic Compounds and Natural Products for Phase 1 and Phase 2 Metabolic Enzymes}, journal = {J. Chem. Inf. Model.}, volume = {59}, number = {8}, pages = {3400--3412}, year = {2019}, url = {https://doi.org/10.1021/acs.jcim.9b00376}, doi = {10.1021/ACS.JCIM.9B00376}, timestamp = {Tue, 01 Jun 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/SichoSMKPTVSK19.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/ChenKK17, author = {Ya Chen and Christina de Bruyn Kops and Johannes Kirchmair}, title = {Data Resources for the Computer-Guided Discovery of Bioactive Natural Products}, journal = {J. Chem. Inf. Model.}, volume = {57}, number = {9}, pages = {2099--2111}, year = {2017}, url = {https://doi.org/10.1021/acs.jcim.7b00341}, doi = {10.1021/ACS.JCIM.7B00341}, timestamp = {Mon, 28 Aug 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/ChenKK17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/FriedrichKFSRK17, author = {Nils{-}Ole Friedrich and Christina de Bruyn Kops and Florian Flachsenberg and Kai Sommer and Matthias Rarey and Johannes Kirchmair}, title = {Benchmarking Commercial Conformer Ensemble Generators}, journal = {J. Chem. Inf. Model.}, volume = {57}, number = {11}, pages = {2719--2728}, year = {2017}, url = {https://doi.org/10.1021/acs.jcim.7b00505}, doi = {10.1021/ACS.JCIM.7B00505}, timestamp = {Mon, 28 Aug 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/FriedrichKFSRK17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/FriedrichMKSFRK17, author = {Nils{-}Ole Friedrich and Agnes Meyder and Christina de Bruyn Kops and Kai Sommer and Florian Flachsenberg and Matthias Rarey and Johannes Kirchmair}, title = {High-Quality Dataset of Protein-Bound Ligand Conformations and Its Application to Benchmarking Conformer Ensemble Generators}, journal = {J. Chem. Inf. Model.}, volume = {57}, number = {3}, pages = {529--539}, year = {2017}, url = {https://doi.org/10.1021/acs.jcim.6b00613}, doi = {10.1021/ACS.JCIM.6B00613}, timestamp = {Fri, 06 Mar 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcisd/FriedrichMKSFRK17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/KopsFK17, author = {Christina de Bruyn Kops and Nils{-}Ole Friedrich and Johannes Kirchmair}, title = {Alignment-Based Prediction of Sites of Metabolism}, journal = {J. Chem. Inf. Model.}, volume = {57}, number = {6}, pages = {1258--1264}, year = {2017}, url = {https://doi.org/10.1021/acs.jcim.7b00165}, doi = {10.1021/ACS.JCIM.7B00165}, timestamp = {Mon, 28 Aug 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/KopsFK17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcisd/SichoKSSK17, author = {Martin S{\'{\i}}cho and Christina de Bruyn Kops and Conrad Stork and Daniel Svozil and Johannes Kirchmair}, title = {{FAME} 2: Simple and Effective Machine Learning Model of Cytochrome {P450} Regioselectivity}, journal = {J. Chem. Inf. Model.}, volume = {57}, number = {8}, pages = {1832--1846}, year = {2017}, url = {https://doi.org/10.1021/acs.jcim.7b00250}, doi = {10.1021/ACS.JCIM.7B00250}, timestamp = {Mon, 28 Aug 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcisd/SichoKSSK17.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
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