TUM-DAML/synthetic_coordinates
Synthetic coordinates for GNNs, as proposed in "Directional Message Passing on Molecular Graphs via Synthetic Coordinates" (NeurIPS 2021)
PythonNOASSERTION
Stargazers
- amarsh1University of Warwick
- Ankita-V2
- arpastranaPrinceton University
- chao1224UC Berkeley & Caltech
- engelberger
- gabegomes
- gasteigerjoGoogle Research
- HakeemDemiLondon UK
- hansen7@Genentech, @Stanford
- huyhoang17HUST
- jgmizeTulsa, OK
- kjappelbaumEPFL
- Leticia-maria@JuliaChemicalReactions, @HartreeFoca
- lightaimeCAMEL-AI.org
- limesqueezyAthens, Greece
- linminhtooQDX
- mattwthompsonOpen Molecular Software Foundation
- nikitavoloboevTbilisi
- pavankumIrvine
- rohanvarmFrontier Medicines
- rohithsrinivaasBerkeley Lab
- sailfish009freelancer
- sandipgiri576IIT Kharagpur
- thu-wangz17Beijing, China
- xnuohzFudan University
- YangLing0818Peking University
- yilunliaoMIT
- yuxuanliao