Haoyang Wu

9PUBLICATIONS
35CO-AUTHORS
Formal methods for softwareTheoretical quantum chemistryChemical and thermal processes in energy and combustionComputational chemistryChemical thermodynamics and energetics
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Publications (9)

|Dec 26, 2025
Chemprop v2: An Efficient, Modular Machine Learning Package for Chemical Property Prediction.

David E Graff, Nathan K Morgan, Jackson W Burns

|Apr 20, 2025
Toward Accurate Quantum Mechanical Thermochemistry: (2) Optimal Methods for Enthalpy Calculations from Comprehensive Benchmarks of 284 Model Chemistries.

Haoyang Wu, Anna C Doner, Hao-Wei Pang

|Dec 03, 2024
Integrating Machine Learning and Large Language Models to Advance Exploration of Electrochemical Reactions.

Zhiling Zheng, Federico Florit, Brooke Jin

|Aug 06, 2024
When Do Quantum Mechanical Descriptors Help Graph Neural Networks to Predict Chemical Properties?

Shih-Cheng Li, Haoyang Wu, Angiras Menon

|May 16, 2024
Toward Accurate Quantum Mechanical Thermochemistry: (1) Extensible Implementation and Comparison of Bond Additivity Corrections and Isodesmic Reactions.

Haoyang Wu, A Mark Payne, Hao-Wei Pang

|Dec 26, 2023
Chemprop: A Machine Learning Package for Chemical Property Prediction.

Esther Heid, Kevin P Greenman, Yunsie Chung

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Frequent Collaborators

9 joint publications

William H Green

3 joint publications

Hao-Wei Pang

3 joint publications

Kevin P Greenman

3 joint publications

Shih-Cheng Li