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Knut Baumann

Showing results (1-10 of 60) with videos related to

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Journal of Chemical Information and Computer Sciences|February 22, 2002
An alignment-independent versatile structure descriptor for QSAR and QSPR based on the distribution of molecular featuresKnut Baumann
Pharmazie in Unserer Zeit|April 5, 2005
[New microtubule stabilizers]Knut Baumann
Journal of Chemical Information and Modeling|June 1, 2005
Structure-based validation of the 3D-QSAR technique MaPNikolaus Stiefl, Knut Baumann
Molecular Informatics|January 27, 2017
Big Data and Deep Learning: A New Age of Molecular Informatics?Knut Baumann, Gisbert Schneider
Journal of Chemical Information and Modeling|May 23, 2014
inSARa: intuitive and interactive SAR interpretation by reduced graphs and hierarchical MCS-based network navigationSabrina Wollenhaupt, Knut Baumann
Journal of Cheminformatics|December 16, 2014
Reliable estimation of prediction errors for QSAR models under model uncertainty using double cross-validationDésirée Baumann, Knut Baumann
Journal of Computer-Aided Molecular Design|February 26, 2005
Validation tools for variable subset regressionKnut Baumann, Nikolaus Stiefl
Journal of Medicinal Chemistry|April 4, 2003
Mapping property distributions of molecular surfaces: algorithm and evaluation of a novel 3D quantitative structure-activity relationship techniqueNikolaus Stiefl, Knut Baumann
Journal of Cheminformatics|April 26, 2014
inSARa: intuitive single-target (large-scale) SAR interpretation and multi-target cross-reactivity analysisSabrina Wollenhaupt, Knut Baumann
Journal of Chemical Information and Modeling|April 3, 2008
Impact of benchmark data set topology on the validation of virtual screening methods: exploration and quantification by spatial statisticsSebastian G Rohrer, Knut Baumann
Pageof 6

Showing results (1-10 of 60) with videos related to

Sort By:
Pageof 6
Journal of Chemical Information and Computer Sciences|February 22, 2002
An alignment-independent versatile structure descriptor for QSAR and QSPR based on the distribution of molecular featuresKnut Baumann
Pharmazie in Unserer Zeit|April 5, 2005
[New microtubule stabilizers]Knut Baumann
Journal of Chemical Information and Modeling|June 1, 2005
Structure-based validation of the 3D-QSAR technique MaPNikolaus Stiefl, Knut Baumann
Molecular Informatics|January 27, 2017
Big Data and Deep Learning: A New Age of Molecular Informatics?Knut Baumann, Gisbert Schneider
Journal of Chemical Information and Modeling|May 23, 2014
inSARa: intuitive and interactive SAR interpretation by reduced graphs and hierarchical MCS-based network navigationSabrina Wollenhaupt, Knut Baumann
Journal of Cheminformatics|December 16, 2014
Reliable estimation of prediction errors for QSAR models under model uncertainty using double cross-validationDésirée Baumann, Knut Baumann
Journal of Computer-Aided Molecular Design|February 26, 2005
Validation tools for variable subset regressionKnut Baumann, Nikolaus Stiefl
Journal of Medicinal Chemistry|April 4, 2003
Mapping property distributions of molecular surfaces: algorithm and evaluation of a novel 3D quantitative structure-activity relationship techniqueNikolaus Stiefl, Knut Baumann
Journal of Cheminformatics|April 26, 2014
inSARa: intuitive single-target (large-scale) SAR interpretation and multi-target cross-reactivity analysisSabrina Wollenhaupt, Knut Baumann
Journal of Chemical Information and Modeling|April 3, 2008
Impact of benchmark data set topology on the validation of virtual screening methods: exploration and quantification by spatial statisticsSebastian G Rohrer, Knut Baumann
Pageof 6