public stuff
A collection of public stuff I have been working on over the years, including milestones, publications and coding projects.
codegabioinfThis website.workAlchemistrySOTA Alchemical free energy calculations for drug discoverymilestoneISM001-055AI-discovered drug now in Phase 2 clinical trials for IPF
workGenerative Hit-Opt with AlchemistryA diffusion-based generative model for small molecule design
publicationColabindA Cloud-based approach for prediction of binding sitesmilestoneYoungFaceWinners of LongHack 2022
researchNN-Enhanced ABFEML/MM for binding free energy
codedioxus-splineSpline scenes in Dioxus!