miaritowa's Stars
he2121/MyRPCFromZero
从零开始,手写一个RPC,任何人都能看懂
chaitjo/geometric-gnn-dojo
Geometric GNN Dojo provides unified implementations and experiments to explore the design space of Geometric Graph Neural Networks.
LiuChuang0059/Complex-Network
复杂网络研究资源整理和基础知识学习
igashov/RetroBridge
RetroBridge: Markov Bridge Model for Retrosynthesis Planning
molecule-one/megan
Code for "Molecule Edit Graph Attention Network: Modeling Chemical Reactions as Sequences of Graph Edits"
ejklike/tied-twoway-transformer
LingxiaoShawn/GNNAsKernel
Source code for From Stars to Subgraphs (ICLR 2022)
coleygroup/rxn-ebm
Energy-based modeling of chemical reactions
yuewan2/Retroformer
MolecularAI/Chemformer
kaist-amsg/LocalTransform
Predicting Organic Reactivity with LocalTransform
uta-smile/RetroXpert
bigchem/synthesis
Contains results and data from Augmented Transformer article
wangxr0526/RetroPrime
Code for Single-step Retrosynthesis model Retroprime
SongtaoLiu0823/FusionRetro
[ICML 2023] FusionRetro: Molecule Representation Fusion via In-Context Learning for Retrosynthetic Planning