Steven M Kearnes

8PUBLICATIONS
28CO-AUTHORS
Statistical mechanics in chemistryProteins and peptidesModelling and simulationOpen accessReaction engineering (excl. nuclear reactions)
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Publications (8)

|Dec 09, 2024
Ordinal Confidence Level Assignments for Regression Model Predictions.

Steven Kearnes, Patrick Riley

|Nov 04, 2024
A Target Class Ligandability Evaluation of WD40 Repeat-Containing Proteins.

Suzanne Ackloo, Fengling Li, Magda Szewczyk

|Jul 05, 2023
Data Sharing in Chemistry: Lessons Learned and a Case for Mandating Structured Reaction Data.

Rocío Mercado, Steven M Kearnes, Connor W Coley

|Nov 02, 2021
The Open Reaction Database.

Steven M Kearnes, Michael R Maser, Michael Wleklinski

|Jun 24, 2020
Author Correction: Optimization of Molecules via Deep Reinforcement Learning.

Zhenpeng Zhou, Steven Kearnes, Li Li

|Jul 26, 2019
Optimization of Molecules via Deep Reinforcement Learning.

Zhenpeng Zhou, Steven Kearnes, Li Li

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Frequent Collaborators

4 joint publications

Patrick Riley

2 joint publications

Zhenpeng Zhou

2 joint publications

Connor W Coley

1 joint publications

Suzanne Ackloo