David Benjamin Ascher
University of Cambridge
1 paper in the Anchorcite directory, published in 2015, cited 5,779 times in total.
ORCID profileResearch topics
- Computational Drug Discovery Methods · 1 paper
- Machine Learning in Materials Science · 1 paper
- Click Chemistry and Applications · 1 paper
Frequent co-authors
- Douglas E. V. Pires · 1 paper
- Tom L. Blundell · 1 paper
Papers
- pkCSM: Predicting Small-Molecule Pharmacokinetic and Toxicity Properties Using Graph-Based SignaturesJournal of Medicinal Chemistry · 2015 · 5,779 citations
Drug development has a high attrition rate, with poor pharmacokinetic and safety properties a significant hurdle. Computational approaches may help minimize these risks. We have developed a novel approach (pkCSM) which uses graph-based signatures to develop predictive models of central…
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