Davy Guan

Researcher, A&DS, Commonwealth Scientific and Industrial Research Organisation, CSIRO

Joined

May 2025

Names

Davy Guan (Preferred)

Emails

****@data61.csiro.au (Confirmed)

,

****@gmail.com (Confirmed)

,

****@imb.uq.edu.au

Personal Links

Career & Education History

Researcher

A&DS, Commonwealth Scientific and Industrial Research Organisation, CSIRO (data61.csiro.au)

2023 – Present

Postdoc

IMB, The University of Queensland (uq.edu.au)

2021 – 2023

PhD student

Medicine, University of Sydney, University of Sydney (uni.sydney.edu.au)

2016 – 2020

Advisors, Relations & Conflicts

Postdoc Advisor

Johannes Zuegg

2021 – 2023

PhD Advisor

2016 – 2020

Expertise

chemoinformatics

2015 – Present

Publications

ATOM: A Pretrained Neural Operator for Multitask Molecular Dynamics
Luke Thompson, Davy Guan, Slade Matthews, Dai Shi, Junbin Gao, Andi Han
- ICLR 2026 Poster
- Readers: Everyone
A comparison of molecular representations for lipophilicity quantitative structure-property relationships with results from the SAMPL6 logP Prediction Challenge
Raymond Lui, Davy Guan, Slade Matthews
- J. Comput. Aided Mol. Des. 2020
- Readers: Everyone
LogP prediction performance with the SMD solvation model and the M06 density functional family for SAMPL6 blind prediction challenge molecules
Davy Guan, Raymond Lui, Slade Matthews
- J. Comput. Aided Mol. Des. 2020
- Readers: Everyone

Co-Authors