BioSystems Engineering and Control Group
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- mhn-react Public Forked from ml-jku/mhn-react
Modern Hopfield Network (MHN) for template relevance prediction
- GLN Public Forked from Hanjun-Dai/GLN
Implementation of Retrosynthesis Prediction with Conditional Graph Logic Network
- Enzyformer Public Forked from Tiantao2000/Enzyformer
Enzyformer: Enhancing Enzymatic Retrosynthesis via Pretrained Transformers
- CLAIRE Public Forked from zishuozeng/CLAIRE
Contrastive Learning-based AnnotatIon for Reaction's EC number
- mpek Public Forked from kotori-y/mpek
MPEK is a universal tool for predicting enzyme turnover number (kcat) and Michaelis-Menten constant (Km) for all types of enzymes. BTW, an online prediction server is also provided.
- Leak-CURBER Public
- eMOSAIC Public Forked from XieResearchGroup/eMOSAIC
Source code for "Multimodal out-of-distribution individual uncertainty quantification enhances binding affinity prediction for polypharmacology" (Nature Machine Intelligence)
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