EXPLORE THE UNIVERSITY OF OXFORD'S WORLD-CLASS RESEARCH

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1
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Conference item

SuCOS: A pharmacophoric-shape overlap metric for comparing binding modes

  • Leung, S, Bodkin, M, von Delft, F, et al.
  • 2019-03-31
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2
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Working paper

SuCOS is better than RMSD for evaluating fragment elaboration and docking poses

  • Leung, S, Bodkin, M, Von Delft, F, et al.
  • 2019
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3
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Journal article

Large-scale analysis of water stability in bromodomain binding pockets with grand canonical Monte Carlo

  • Aldeghi, M, Ross, G, Bodkin, M, et al.
  • 2018-04-05
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4
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Journal article

Predictions of ligand selectivity from absolute binding free energy calculations

  • Aldeghi, M, Heifetz, A, Bodkin, M, et al.
  • 2016-12-23
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