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Gregory A. Landrum

Showing results (1-10 of 35) with videos related to

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Journal of Chemical Information and Modeling|February 23, 2024
Combining IC<sub>50</sub> or <i>K</i><sub></sub> Values from Different Sources Is a Source of Significant NoiseGregory A Landrum, Sereina Riniker
Angewandte Chemie (International Ed. in English)|February 13, 2001
ReplyGregory A. Landrum, Richard Dronskowski
Angewandte Chemie (International Ed. in English)|May 2, 2018
Ferromagnetism in Transition Metals: A Chemical Bonding ApproachGregory A Landrum, Richard Dronskowski
Journal of Chemical Information and Modeling|November 18, 2015
Better Informed Distance Geometry: Using What We Know To Improve Conformation GenerationSereina Riniker, Gregory A Landrum
Journal of Cheminformatics|June 1, 2013
Open-source platform to benchmark fingerprints for ligand-based virtual screeningSereina Riniker, Gregory A Landrum
Journal of Cheminformatics|September 26, 2013
Similarity maps - a visualization strategy for molecular fingerprints and machine-learning methodsSereina Riniker, Gregory A Landrum
Future Medicinal Chemistry|October 24, 2012
Is that a scientific publication or an advertisement? Reproducibility, source code and data in the computational chemistry literatureGregory A Landrum, Nikolaus Stiefl
Journal of Chemical Information and Modeling|June 26, 2020
rdScaffoldNetwork: The Scaffold Network Implementation in RDKitFranziska Kruger, Nikolaus Stiefl, Gregory A Landrum
Journal of Chemical Information and Modeling|December 28, 2016
What's What: The (Nearly) Definitive Guide to Reaction Role AssignmentNadine Schneider, Nikolaus Stiefl, Gregory A Landrum
Journal of Chemical Information and Modeling|November 1, 2013
Heterogeneous classifier fusion for ligand-based virtual screening: or, how decision making by committee can be a good thingSereina Riniker, Nikolas Fechner, Gregory A Landrum
Pageof 4

Showing results (1-10 of 35) with videos related to

Sort By:
Pageof 4
Journal of Chemical Information and Modeling|February 23, 2024
Combining IC<sub>50</sub> or <i>K</i><sub></sub> Values from Different Sources Is a Source of Significant NoiseGregory A Landrum, Sereina Riniker
Angewandte Chemie (International Ed. in English)|February 13, 2001
ReplyGregory A. Landrum, Richard Dronskowski
Angewandte Chemie (International Ed. in English)|May 2, 2018
Ferromagnetism in Transition Metals: A Chemical Bonding ApproachGregory A Landrum, Richard Dronskowski
Journal of Chemical Information and Modeling|November 18, 2015
Better Informed Distance Geometry: Using What We Know To Improve Conformation GenerationSereina Riniker, Gregory A Landrum
Journal of Cheminformatics|June 1, 2013
Open-source platform to benchmark fingerprints for ligand-based virtual screeningSereina Riniker, Gregory A Landrum
Journal of Cheminformatics|September 26, 2013
Similarity maps - a visualization strategy for molecular fingerprints and machine-learning methodsSereina Riniker, Gregory A Landrum
Future Medicinal Chemistry|October 24, 2012
Is that a scientific publication or an advertisement? Reproducibility, source code and data in the computational chemistry literatureGregory A Landrum, Nikolaus Stiefl
Journal of Chemical Information and Modeling|June 26, 2020
rdScaffoldNetwork: The Scaffold Network Implementation in RDKitFranziska Kruger, Nikolaus Stiefl, Gregory A Landrum
Journal of Chemical Information and Modeling|December 28, 2016
What's What: The (Nearly) Definitive Guide to Reaction Role AssignmentNadine Schneider, Nikolaus Stiefl, Gregory A Landrum
Journal of Chemical Information and Modeling|November 1, 2013
Heterogeneous classifier fusion for ligand-based virtual screening: or, how decision making by committee can be a good thingSereina Riniker, Nikolas Fechner, Gregory A Landrum
Pageof 4