Garrett M Morris
11PUBLICATIONS
51CO-AUTHORS
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Publications (11)
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|Feb 08, 2025
Narrowing the gap between machine learning scoring functions and free energy perturbation using augmented data.Ísak Valsson, Matthew T Warren, Charlotte M Deane
|Mar 12, 2024
It is theoretically possible to avoid misfolding into non-covalent lasso entanglements using small molecule drugs.Yang Jiang, Charlotte M Deane, Garrett M Morris
|Mar 01, 2024
PoseBusters: AI-based docking methods fail to generate physically valid poses or generalise to novel sequences.Martin Buttenschoen, Garrett M Morris, Charlotte M Deane
|Sep 16, 2023
Discovery and pharmacophoric characterization of chemokine network inhibitors using phage-display, saturation mutagenesis and computational modelling.Serena Vales, Jhanna Kryukova, Soumyanetra Chandra
|Nov 11, 2021
Discovery of SARS-CoV-2 Mpro peptide inhibitors from modelling substrate and ligand binding.H T Henry Chan, Marc A Moesser, Rebecca K Walters
|Sep 01, 2021
Learning from Docked Ligands: Ligand-Based Features Rescue Structure-Based Scoring Functions When Trained on Docked Poses.Fergus Boyles, Charlotte M Deane, Garrett M Morris
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Frequent Collaborators
6 joint publications
Charlotte M Deane
3 joint publications
Lucian Chan
3 joint publications
Geoffrey R Hutchison
2 joint publications
Philip C Biggin
1 joint publications
Jean-Paul Ebejer
1 joint publications
Wing Ki Wong
1 joint publications
Rocco Meli
1 joint publications
Andrew Anighoro
1 joint publications
Mike J Bodkin
1 joint publications
Fergus Boyles
