Pinned Repositories
chembl_webresource_client
Official Python client for accessing ChEMBL API.
cheminfo_tutorial_20241028_pub
dagdata
Data for the HarvardX courses: PH525x
data-science-learning-resources
A collection of data science and machine learning resources that I've found helpful (I only post what I've read!)
Fragmenstein
Scaffold hopping between bound compounds by stitching them together like a reanimated corpse.
GWASTutorial
GWAS Tutorial for Beginners
InteractiveComplexHeatmap
Make Interactive Complex Heatmaps
ivadomed
Repository on the collaborative IVADO medical imaging project between the Mila and NeuroPoly labs.
labs
Rmd source files for the HarvardX series PH525x
Kaziaa's Repositories
Kaziaa/cheminfo_tutorial_20241028_pub
Kaziaa/data-science-learning-resources
A collection of data science and machine learning resources that I've found helpful (I only post what I've read!)
Kaziaa/GWASTutorial
GWAS Tutorial for Beginners
Kaziaa/ML_medbioinfo
Machine Learning in Medical Bioinformatics
Kaziaa/practical_cheminformatics_tutorials
Practical Cheminformatics Tutorials
Kaziaa/3D-Generative-SBDD
💊 A 3D Generative Model for Structure-Based Drug Design (NeurIPS 2021)
Kaziaa/ai_in_chemistry_workshop
ai_in_chemistry_workshop
Kaziaa/awesome-molecular-generation
Awesome papers related to generative molecular modeling and design.
Kaziaa/awesome-transformers-in-medical-imaging
A collection of resources on applications of Transformers in Medical Imaging.
Kaziaa/bash-handbook
:book: For those who wanna learn Bash
Kaziaa/chembl_targetprediction
Kaziaa/generative-ai-for-beginners
18 Lessons, Get Started Building with Generative AI 🔗 https://microsoft.github.io/generative-ai-for-beginners/
Kaziaa/Generative-model
The official implementation of 3D Equivariant Diffusion for Target-Aware Molecule Generation and Affinity Prediction (ICLR 2023)
Kaziaa/git-collaborative
Collaborative distributed version control lesson.
Kaziaa/jazzy
Efficient calculation of hydration free energies and hydrogen-bond strengths.
Kaziaa/Kaziaa
Kaziaa/Kinase-Cross-Dock
Benchmarking of cross-docking strategies for kinases
Kaziaa/kinase-kinoml
Structure-informed machine learning for kinase modeling
Kaziaa/Machine_learning
An Open Source Machine Learning Framework for Everyone
Kaziaa/Pharmacopjhore--MolSLEPA
Interpretable Fragment-based Molecule Design with Self-learning Entropic Population Annealing
Kaziaa/pqsar2cpd
pqsar2cpd is a deep learning algorithm for translation of activity profiles into novel molecules.
Kaziaa/Python-to-Learn
Kaziaa/REINVENT4
AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.
Kaziaa/squidpy
Spatial Single Cell Analysis in Python
Kaziaa/teachopencadd
TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
Kaziaa/Teal-Teal-Interactive-Exploratory-Data-Analysis-with-Shiny-Web-Applications
Exploratory Web Apps for Analyzing Clinical Trial Data
Kaziaa/tensorflow-deep-learning
All course materials for the Zero to Mastery Deep Learning with TensorFlow course.
Kaziaa/tidymodules
An Object-Oriented approach to Shiny modules
Kaziaa/Toxicityprediciotn-mitochondrial-tox
Supporting information from "Predicting the Mitochondrial Toxicity of Small Molecules: Insights From Mechanistic Assays and Cell Painting Data" by Marina Garcia de Lomana, Paula Andrea Marin Zapata, and Floriane Montanari
Kaziaa/training-collection
Collection of bioinformatics training materials