Hao-Wei Pang

8PUBLICATIONS
28CO-AUTHORS
Biomolecular modelling and designFormal methods for softwareDeep learningAdversarial machine learningTheoretical quantum chemistry
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Publications (8)

|Aug 10, 2026
Scalable and Generalizable Analog Design via Learning Medicinal Chemistry Intuition from Matched Molecular Pair Transformations.

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

David E Graff, Nathan K Morgan, Jackson W Burns

|Oct 22, 2025
PySIDT: Subgraph Isomorphic Decision Trees for Molecular Property Prediction.

Matthew S Johnson, Hao-Wei Pang, Anna C Doner

|Oct 08, 2025
RIGR: Resonance-Invariant Graph Representation for Molecular Property Prediction.

Akshat Shirish Zalte, Hao-Wei Pang, Anna C Doner

|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

|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

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Frequent Collaborators

7 joint publications

William H Green

3 joint publications

Matthew S Johnson

3 joint publications

Xiaorui Dong

3 joint publications

Haoyang Wu