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Biological and Medicinal Chemistry

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Theoretical and Computational Chemistry

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Fergus Boyles

2 results in Authors: Fergus Boyles

Theoretical and Computational Chemistry

Learning from the Ligand: Using Ligand-Based Features to Improve Binding Affinity Prediction

Fergus Boyles, Charlotte M Deane, Garrett Morris

Version 1 posted 23 May 2019

771

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1

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Theoretical and Computational Chemistry

Learning from Docked Ligands: Ligand-Based Features Rescue Structure-Based Scoring Functions When Trained On Docked Poses

Fergus Boyles, Charlotte M Deane, Garrett Morris

Version 1 posted 27 January 2021

752

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