Gregory L Warren
4PUBLICATIONS
11CO-AUTHORS
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Publications (4)
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|Dec 23, 2025
The impossible made possible through the use of New Approach Methodologies: Dermal safety assessment of potential insect repellent or insecticidal active ingredients using a high-throughput approach to the in vitro Skin Irritation Test (OECD TG 439).Huang Huang, Jacob N Sanders, Gregory L Warren
|Nov 16, 2022
Best practices for constructing, preparing, and evaluating protein-ligand binding affinity benchmarks [Article v0.1].David F Hahn, Christopher I Bayly, Hannah E Bruce Macdonald
|Mar 14, 2020
Fragment Pose Prediction Using Non-equilibrium Candidate Monte Carlo and Molecular Dynamics Simulations.Nathan M Lim, Meghan Osato, Gregory L Warren
|Mar 06, 2019
Biomolecular Solvation Structure Revealed by Molecular Dynamics Simulations.Michael E Wall, Gaetano Calabró, Christopher I Bayly
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Frequent Collaborators
3 joint publications
David L Mobley
1 joint publications
Michael E Wall
1 joint publications
David F Hahn
1 joint publications
Christopher I Bayly
1 joint publications
Hannah E Bruce Macdonald
1 joint publications
John D Chodera
1 joint publications
Antonia S J S Mey
1 joint publications
Laura Perez Benito
1 joint publications
Christina E M Schindler
1 joint publications
Gary Tresadern
