Molecular Machine Learning
- 45 followers
- Eindhoven, The Netherlands
- https://molecularmachinelearning.com/
Popular repositories Loading
-
MoleculeACE
MoleculeACE PublicA tool for evaluating the predictive performance on activity cliff compounds of machine learning models
-
s4-for-de-novo-drug-design
s4-for-de-novo-drug-design PublicThe official codebase of the paper "Chemical language modeling with structured state space sequence models"
-
-
chemical-language-processing-for-bioactivity-prediction
chemical-language-processing-for-bioactivity-prediction PublicThe official codebase for the paper "A Hitchhiker's Guide to Deep Chemical Language Processing for Bioactivity Prediction"
Repositories
- fragSMILES4reaction Public
molML/fragSMILES4reaction’s past year of commit activity - deep-cocrystal Public
The official codebase of the paper "Deep Supramolecular Language Processing for Co-crystal Prediction"
molML/deep-cocrystal’s past year of commit activity - 14-3-3-bindsite Public
molML/14-3-3-bindsite’s past year of commit activity - JointMolecularModel Public
Using a joint AE and property prediction model to estimate OOD molecules and quantify uncertainty
molML/JointMolecularModel’s past year of commit activity - chemical-language-processing-for-bioactivity-prediction Public
The official codebase for the paper "A Hitchhiker's Guide to Deep Chemical Language Processing for Bioactivity Prediction"
molML/chemical-language-processing-for-bioactivity-prediction’s past year of commit activity - RUSH Public
molML/RUSH’s past year of commit activity - MoleculeACE Public
A tool for evaluating the predictive performance on activity cliff compounds of machine learning models
molML/MoleculeACE’s past year of commit activity
People
This organization has no public members. You must be a member to see who’s a part of this organization.
Top languages
Loading…
Most used topics
Loading…