- ๐ญ Iโm currently working on Parkinson's disease, machine learning in drug discovery, molecular docking and molecular dynamics simulations
- ๐ฑ Iโm currently learning artificial intelligence for drug discovery
- ๐ฏ Iโm looking to collaborate on in silico drug discovery projects
- ๐ค Iโm looking for help with free energy perturbations and umbrella sampling methods
- ๐ฌ Ask me about molecular docking, molecular dynamics simulations and QSAR modelling
- ๐ซ How to reach me: [email protected]
yboulaamane / ensemblebbb Goto Github PK
View Code? Open in Web Editor NEWEnhanced accuracy in predicting drug blood-brain barrier permeability with a Machine Learning Ensemble model