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@article{DBLP:journals/jcheminf/AbreuFQF10, author = {Rui M. V. Abreu and Hugo J. C. Froufe and Maria Queiroz and Isabel C. F. R. Ferreira}, title = {{MOLA:} a bootable, self-configuring system for virtual screening using AutoDock4/Vina on computer clusters}, journal = {J. Cheminformatics}, volume = {2}, pages = {10}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-10}, doi = {10.1186/1758-2946-2-10}, timestamp = {Thu, 14 Feb 2019 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/AbreuFQF10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/Clark10, author = {Alex M. Clark}, title = {Basic primitives for molecular diagram sketching}, journal = {J. Cheminformatics}, volume = {2}, pages = {8}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-8}, doi = {10.1186/1758-2946-2-8}, timestamp = {Thu, 14 Feb 2019 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/Clark10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/DeHavenEDL10, author = {Corey D. DeHaven and Anne M. Evans and Hongping Dai and Kay A. Lawton}, title = {Organization of {GC/MS} and {LC/MS} metabolomics data into chemical libraries}, journal = {J. Cheminformatics}, volume = {2}, pages = {9}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-9}, doi = {10.1186/1758-2946-2-9}, timestamp = {Sat, 30 Sep 2023 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcheminf/DeHavenEDL10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/Ertl10, author = {Peter Ertl}, title = {Molecular structure input on the web}, journal = {J. Cheminformatics}, volume = {2}, pages = {1}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-1}, doi = {10.1186/1758-2946-2-1}, timestamp = {Wed, 14 Nov 2018 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/Ertl10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/FechnerJHZ10, author = {Nikolas Fechner and Andreas Jahn and Georg Hinselmann and Andreas Zell}, title = {Estimation of the applicability domain of kernel-based machine learning models for virtual screening}, journal = {J. Cheminformatics}, volume = {2}, pages = {2}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-2}, doi = {10.1186/1758-2946-2-2}, timestamp = {Mon, 01 Jul 2019 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcheminf/FechnerJHZ10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/HardyDHRJJNBTKGBWKGMSMASGPFZLGNSDCGRPE10, author = {Barry J. Hardy and Nicki Douglas and Christoph Helma and Micha Rautenberg and Nina Jeliazkova and Vedrin Jeliazkov and Ivelina Nikolova and Romualdo Benigni and Olga Tcheremenskaia and Stefan Kramer and Tobias Girschick and Fabian Buchwald and J{\"{o}}rg Wicker and Andreas Karwath and Martin G{\"{u}}tlein and Andreas Maunz and Haralambos Sarimveis and Georgia Melagraki and Antreas Afantitis and Pantelis Sopasakis and David Gallagher and Vladimir Poroikov and Dmitry Filimonov and Alexey V. Zakharov and Alexey Lagunin and Tatyana Gloriozova and Sergey Novikov and Natalia Skvortsova and Dmitry S. Druzhilovskiy and Sunil Chawla and Indira Ghosh and Surajit Ray and Hitesh Patel and Sylvia Escher}, title = {Collaborative development of predictive toxicology applications}, journal = {J. Cheminformatics}, volume = {2}, pages = {7}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-7}, doi = {10.1186/1758-2946-2-7}, timestamp = {Wed, 14 Jul 2021 01:00:00 +0200}, biburl = {https://dblp.org/rec/journals/jcheminf/HardyDHRJJNBTKGBWKGMSMASGPFZLGNSDCGRPE10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/HettneWMKTK10, author = {Kristina M. Hettne and Antony J. Williams and Erik M. van Mulligen and Jos Kleinjans and Valery Tkachenko and Jan A. Kors}, title = {Automatic vs. manual curation of a multi-source chemical dictionary: the impact on text mining}, journal = {J. Cheminformatics}, volume = {2}, pages = {3}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-3}, doi = {10.1186/1758-2946-2-3}, timestamp = {Thu, 14 Feb 2019 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/HettneWMKTK10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/HettneWMKTK10a, author = {Kristina M. Hettne and Antony J. Williams and Erik M. van Mulligen and Jos Kleinjans and Valery Tkachenko and Jan A. Kors}, title = {Automatic vs. manual curation of a multi-source chemical dictionary: the impact on text mining (Correction)}, journal = {J. Cheminformatics}, volume = {2}, pages = {4}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-4}, doi = {10.1186/1758-2946-2-4}, timestamp = {Thu, 14 Feb 2019 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/HettneWMKTK10a.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/LangdonMPH10, author = {Sarah R. Langdon and Joanna Mulgrew and Gaia Valeria Paolini and Willem P. van Hoorn}, title = {Predicting cytotoxicity from heterogeneous data sources with Bayesian learning}, journal = {J. Cheminformatics}, volume = {2}, pages = {11}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-11}, doi = {10.1186/1758-2946-2-11}, timestamp = {Mon, 26 Oct 2020 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/LangdonMPH10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/SpjuthWGEW10, author = {Ola Spjuth and Egon L. Willighagen and Rajarshi Guha and Martin Eklund and Jarl E. S. Wikberg}, title = {Towards interoperable and reproducible {QSAR} analyses: Exchange of datasets}, journal = {J. Cheminformatics}, volume = {2}, pages = {5}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-5}, doi = {10.1186/1758-2946-2-5}, timestamp = {Thu, 14 Feb 2019 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/SpjuthWGEW10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
@article{DBLP:journals/jcheminf/ZhuLDW10, author = {Qian Zhu and Michael S. Lajiness and Ying Ding and David J. Wild}, title = {{WENDI:} {A} tool for finding non-obvious relationships between compounds and biological properties, genes, diseases and scholarly publications}, journal = {J. Cheminformatics}, volume = {2}, pages = {6}, year = {2010}, url = {https://doi.org/10.1186/1758-2946-2-6}, doi = {10.1186/1758-2946-2-6}, timestamp = {Mon, 21 Feb 2022 00:00:00 +0100}, biburl = {https://dblp.org/rec/journals/jcheminf/ZhuLDW10.bib}, bibsource = {dblp computer science bibliography, https://dblp.org} }
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