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JKlee's Projects

alphaflow icon alphaflow

AlphaFold Meets Flow Matching for Generating Protein Ensembles

chroma icon chroma

A generative model for programmable protein design

colabdesign icon colabdesign

Making Protein Design accessible to all via Google Colab!

deeplearningexamples icon deeplearningexamples

State-of-the-Art Deep Learning scripts organized by models - easy to train and deploy with reproducible accuracy and performance on enterprise-grade infrastructure.

diffdock icon diffdock

Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking

dynamicbind icon dynamicbind

repo for DynamicBind: Predicting ligand-specific protein-ligand complex structure with a deep equivariant generative model

evodiff icon evodiff

Generation of protein sequences and evolutionary alignments via discrete diffusion models

frame2seq icon frame2seq

Structure-conditioned masked language modeling for protein sequence design

friendsdontletfriends icon friendsdontletfriends

Friends don't let friends make certain types of data visualization - What are they and why are they bad.

ml-from-scratch icon ml-from-scratch

Machine Learning From Scratch. Bare bones NumPy implementations of machine learning models and algorithms with a focus on accessibility. Aims to cover everything from linear regression to deep learning.

openfold icon openfold

Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2

rdkit icon rdkit

The official sources for the RDKit library

the-incredible-pytorch icon the-incredible-pytorch

The Incredible PyTorch: a curated list of tutorials, papers, projects, communities and more relating to PyTorch.

thermompnn icon thermompnn

GNN trained to predict changes in thermodynamic stability for protein point mutants

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