Pinned Repositories
openfold
Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2
deeprank2
An open-source deep learning framework for data mining of protein-protein interfaces or single-residue variants.
chemical_vae
Code for 10.1021/acscentsci.7b00572, now running on Keras 2.0 and Tensorflow
deep-molecular-massspec
Mass Spectrometry for Small Molecules using Deep Learning
deeprank2-review
Suggested edits from openjournals/joss-reviews#5983
neural-fingerprint
Convolutional nets which can take molecular graphs of arbitrary size as input.
neural_reaction_fingerprint
openfold
Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2
openfold-website
OpenFold website source code.
jnwei's Repositories
jnwei/neural_reaction_fingerprint
jnwei/chemical_vae
Code for 10.1021/acscentsci.7b00572, now running on Keras 2.0 and Tensorflow
jnwei/deep-molecular-massspec
Mass Spectrometry for Small Molecules using Deep Learning
jnwei/deeprank2-review
Suggested edits from openjournals/joss-reviews#5983
jnwei/neural-fingerprint
Convolutional nets which can take molecular graphs of arbitrary size as input.
jnwei/openfold
Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2