Ross Johnstone's repositories
AutoDock-Vina
AutoDock Vina
hacker
Hacker is a Jekyll theme for GitHub Pages
lightning
The most intuitive, flexible, way for researchers, ML engineers and data scientists to build models (with PyTorch) and ML systems for the ML lifecycle with an obsessive focus on flexibility and performance.
ngboost
Natural Gradient Boosting for Probabilistic Prediction
PyHillFit
PyHillFit implemented in PyMC3
PyHillFit-old
Re-write PyHillFit in a better (OO, maybe) way
minima
Minima is a one-size-fits-all Jekyll theme for writers.
minimal-mistakes
:triangular_ruler: Jekyll theme for building a personal site, blog, project documentation, or portfolio.
pytorch_geometric
Graph Neural Network Library for PyTorch
recommend
Playing with recommender systems
rojobot
Playing with GDAX
rpi
A collection of simple Raspberry Pi projects
shrec_2021_shape_retrieval
Codes for Shrec 2021 Surface-based protein domains retrieval track (http://shrec2021.drugdesign.fr/)
smart_open
Utils for streaming large files (S3, HDFS, gzip, bz2...)
TeachOpenCADD
TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
transformers
🤗 Transformers: State-of-the-art Machine Learning for Pytorch, TensorFlow, and JAX.
xgboost-distribution
Probabilistic prediction with XGBoost.