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1. alphafold2 alphafold2 Public

   Forked from lucidrains/alphafold2

   To eventually become an unofficial Pytorch implementation / replication of Alphafold2, as details of the architecture get released

   Python 1

2. mt-dti mt-dti Public

   Forked from deargen/mt-dti

   An official Molecule Transformer Drug Target Interaction (MT-DTI) model

   Python

3. Theano/Theano Theano/Theano Public

   Theano was a Python library that allows you to define, optimize, and evaluate mathematical expressions involving multi-dimensional arrays efficiently. It is being continued as PyTensor: www.github.…

   Python 9.9k 2.5k

4. avogadro avogadro Public

   Forked from cryos/avogadro

   Development of Avogadro 2 is being done at https://github.com/openchemistry/avogadrolibs. Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecu…

   C++

5. tensor2tensor tensor2tensor Public

   Forked from tensorflow/tensor2tensor

   Library of deep learning models and datasets designed to make deep learning more accessible and accelerate ML research.

   Python