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Hi there šŸ‘‹

  • šŸ”­ Iā€™m currently working on Parkinson's disease, machine learning in drug discovery, molecular docking and molecular dynamics simulations
  • šŸŒ± Iā€™m currently learning artificial intelligence for drug discovery
  • šŸ‘Æ Iā€™m looking to collaborate on in silico drug discovery projects
  • šŸ¤” Iā€™m looking for help with free energy perturbations and umbrella sampling methods
  • šŸ’¬ Ask me about molecular docking, molecular dynamics simulations and QSAR modelling
  • šŸ“« How to reach me: [email protected]

Yassir Boulaamane's Projects

artemisiadb icon artemisiadb

A curated database containing chemical information of secondary metabolites isolated from Artemesia L. species.

cdd-toolbox icon cdd-toolbox

A curated list of tools and servers for computer-aided drug design and discovery.

comp_chem_colab icon comp_chem_colab

A useful collection of jupyter notebooks for computational chemists

coumarindb icon coumarindb

A manually curated database containing chemical information for naturally occurring coumarins.

ensemblebbb icon ensemblebbb

Enhanced accuracy in predicting drug blood-brain barrier permeability with a Machine Learning Ensemble model

journal-list-cadd icon journal-list-cadd

A curated list of scientific journals for research in computer-aided drug design and discovery.

qsarbiopred icon qsarbiopred

A Jupyter Notebook to build QSAR classification models for bioactivity prediction.

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