Roger A. Sayle
Publications by Year
Research Areas
Computational Drug Discovery Methods, Biomedical Text Mining and Ontologies, Protein Structure and Dynamics, Enzyme Structure and Function, Analytical Chemistry and Chromatography
Most-Cited Works
- → RASMOL: biomolecular graphics for all(1995)2,596 cited
- → ZINC20—A Free Ultralarge-Scale Chemical Database for Ligand Discovery(2020)966 cited
- → Big Data from Pharmaceutical Patents: A Computational Analysis of Medicinal Chemists’ Bread and Butter(2016)437 cited
- → The CHEMDNER corpus of chemicals and drugs and its annotation principles(2015)416 cited
- → Comparing structural fingerprints using a literature-based similarity benchmark(2016)271 cited
- → Development of a Novel Fingerprint for Chemical Reactions and Its Application to Large-Scale Reaction Classification and Similarity(2014)210 cited
- → Recognition of analogous and homologous protein folds: analysis of sequence and structure conservation 1 1Edited by F. E. Cohen(1997)195 cited
- → Get Your Atoms in Order—An Open-Source Implementation of a Novel and Robust Molecular Canonicalization Algorithm(2015)117 cited
- → So you think you understand tautomerism?(2010)78 cited
- → LeadMine: a grammar and dictionary driven approach to entity recognition(2015)70 cited