Peter V Coveney

58PUBLICATIONS
138CO-AUTHORS
Chemical engineering designComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Biomolecular modelling and designTheoretical quantum chemistryQuantum technologies
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Publications (58)

|Oct 23, 2026
Generative Active Learning for Molecular Design with REINVENT: Balancing Binding Affinity and Synthetic Accessibility.

|Aug 30, 2026
Fast-forward prediction of lattice Boltzmann dynamics with physics-informed neural operators.

|Aug 11, 2026
Reliability of AI Methods in Drug Discovery: Evaluation of Boltz-2 for Structure and Binding Affinity Prediction.

|Apr 22, 2026
Selected Configuration Interaction Using Time-Evolved Population Statistics.

|Apr 17, 2026
Quantum-informed machine learning for predicting spatiotemporal chaos with practical quantum advantage.

|Sep 23, 2025
Bridging Quantum Chemistry and MaxCut: Classical Performance Guarantees and Quantum Algorithms for the Hartree-Fock Method.

Alexis Ralli, Tim Weaving, Peter V Coveney

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Frequent Collaborators

23 joint publications

Shunzhou Wan

7 joint publications

David W Wright

6 joint publications

Agastya P Bhati

5 joint publications

James L Suter