Jonathan D. Tyzack
Orcid: 0000-0003-4827-9023Affiliations:
- Unilever Centre for Molecular Science Informatics, Cambridge, UK
According to our database1,
Jonathan D. Tyzack
authored at least 12 papers
between 2012 and 2022.
Collaborative distances:
Collaborative distances:
Timeline
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Online presence:
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on orcid.org
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Bibliography
2022
GRaSP-web: a machine learning strategy to predict binding sites based on residue neighborhood graphs.
Nucleic Acids Res., 2022
2020
Nucleic Acids Res., 2020
2019
2018
Mechanism and Catalytic Site Atlas (M-CSA): a database of enzyme reaction mechanisms and active sites.
Nucleic Acids Res., 2018
WhichP450: a multi-class categorical model to predict the major metabolising CYP450 isoform for a compound.
J. Comput. Aided Mol. Des., 2018
2016
Predicting Regioselectivity and Lability of Cytochrome P450 Metabolism Using Quantum Mechanical Simulations.
J. Chem. Inf. Model., 2016
2014
Cytochrome P450 site of metabolism prediction from 2D topological fingerprints using GPU accelerated probabilistic classifiers.
J. Cheminformatics, 2014
2013
Prediction of Cytochrome P450 Xenobiotic Metabolism: Tethered Docking and Reactivity Derived from Ligand Molecular Orbital Analysis.
J. Chem. Inf. Model., 2013
FAst MEtabolizer (FAME): A Rapid and Accurate Predictor of Sites of Metabolism in Multiple Species by Endogenous Enzymes.
J. Chem. Inf. Model., 2013
2012
Computational Prediction of Metabolism: Sites, Products, SAR, P450 Enzyme Dynamics, and Mechanisms.
J. Chem. Inf. Model., 2012
Probabilistic classifier: generated using randomised sub-sampling of the feature space.
J. Cheminformatics, 2012