Xuhan Liu
PHD at Leiden University
Leiden, South Holland, Netherlands
Summary
👤
Senior🎓
Top SchoolXuhan Liu is a PhD researcher at Leiden University with eight years of experience applying deep learning to computational drug design, graduating next January. She developed and iterated the generative molecular design method DrugEx (now at v3.0) and helped build GenUI, a web-based interface to make these tools accessible to non-specialists. Her work bridges algorithm development and practical deployment, combining model design, cheminformatics, and user-centered tooling. Based in Leiden, she aims to transition into industry roles at the intersection of AI and drug discovery, bringing both academic rigor and product-minded engineering.
8 years of coding experience
Leiden University
Github Skills (16)
cheminformatics10
reinforcement-learning10
multi-objective-optimization10
optimization10
drug-discovery9
deep-learning9
pytorch9
representations9
chainer7
molecule7
fingerprint7
graph-convolutional-networks5
graph5
predictor3
machine-learning2
Programming languages (2)
Github contributions (5)
XuhanLiu/lemp
Jul 2017 - Nov 2019
Contributions:2 PRs, 25 pushes, 3 branches in 2 years 4 months
pytorchdeep-learninglstmensemblemachine-learning
XuhanLiu/NGFP
Apr 2019 - Dec 2019
PyTorch-based Neural Graph Fingerprint for Organic Molecule Representations
Contributions:26 commits, 24 pushes, 1 branch in 7 months
pytorchgraph-convolutional-networksrepresentationsneural-graphmolecule
Find and Hire Top DevelopersWe’ve analyzed the programming source code of over 60 million software developers on GitHub and scored them by 50,000 skills. Sign-up on Prog,AI to search for software developers.