Publications

Total number of publications: 101
Journals we published most in:
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J. Chem. Inf. Model. - 17 publications.

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J. Med. Chem. - 12 publications.

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Eur. J. Med. Chem. - 5 publications.

Highest impact factor journals we have published in:
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Nature Catalysis - Impact Factor (2024): 42.8

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Accounts of Chemical Research - Impact Factor (2024): 16.4

Our most cited paper (below) has 726 citations (September 2025)!
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Moitessier N., Englebienne P., Lee D., Lawandi J., Corbeil C.R., Towards the development of universal, fast and highly accurate docking/scoring methods: A long way to go. British Journal of Pharmacology (2008), 153, SUPPL. 1, S7-S26

Full List of Publications

Shortlist of Highlighted Publications

Fitted - a Docking Tool

Computational Tools for Drug Discovery

Virtual Chemist - Computational Asymmetric Synthesis

Prolyl Oligopeptidase Covalent Inhibitors

COVID19: 3CLpro and PLpro Covalent Inhibitors

Machine Learning

CYP P450 - Metabolism and Inhibition.

HTEQ - Molecular Mechanics with no Atom Types

RNA therapeutics and RNA-binding therapeutics

Reviews in Medicinal Chemistry

ITC in Medicinal Chemistry (with the Mittermaier Group)