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Patrick Riley

11PUBLICATIONS

49CO-AUTHORS

Cheminformatics and quantitative structure-activity relationshipsStatistical mechanics in chemistryProteins and peptidesBiomolecular modelling and designOptimisation

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Publications (11)

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|Jan 02, 2026

DNA-Encoded Chemical Library Screening with Target Titration Analysis: DELTA.

John C Faver, Flora Sundersingh, Lauren A Viarengo-Baker

|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

|Sep 10, 2024

Extensive exploration of structure activity relationships for the SARS-CoV-2 macrodomain from shape-based fragment merging and active learning.

Galen J Correy, Moira Rachman, Takaya Togo

|Sep 09, 2022

Evolving symbolic density functionals.

He Ma, Arunachalam Narayanaswamy, Patrick Riley

|May 05, 2022

Defining Levels of Automated Chemical Design.

Brian Goldman, Steven Kearnes, Trevor Kramer

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Frequent Collaborators

4 joint publications

Steven Kearnes

2 joint publications

Zhenpeng Zhou

2 joint publications

W Patrick Walters

2 joint publications

John W Cuozzo

1 joint publications

Drew H Bryant

1 joint publications

George M Church

1 joint publications

Lucy J Colwell

1 joint publications

John C Faver

1 joint publications

Levon Halabelian

1 joint publications

Bowen Xu

Frequent Collaborators

4 joint publications

Steven Kearnes

2 joint publications

Zhenpeng Zhou

2 joint publications

W Patrick Walters

2 joint publications

John W Cuozzo

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