john-bradshaw

John Bradshaw's repositories

Code for our paper "A Model to Search for Synthesizable Molecules" (https://arxiv.org/abs/1906.05221)

Language:PythonGPL-3.074 50

Code for our paper "Barking up the right tree: an approach to search over molecule synthesis DAGs"

Language:PythonGPL-3.044 1 3

Graph neural networks

Language:PythonGPL-3.020 30

Core code for the paper "A Generative Model For Electron Paths" (https://openreview.net/forum?id=r1x4BnCqKX).

Language:Jupyter NotebookGPL-3.017 3 3

Tutorial for "Advances in machine learning for molecules" (for Summer School for Machine Learning in Bioinformatics, https://cs.hse.ru/ssml/)

Language:Jupyter NotebookMIT15 1 2

A collection of auto-encoders including VAEs

Language:Jupyter NotebookGPL-3.01 30

Gaussian Processes in PyTorch

Language:PythonGPL-3.01 10

A JavaScript library that parses BibTeX parser.

Language:JavaScriptMIT010

Gaussian processes in TensorFlow

Language:PythonApache-2.0020

My implementation of GraphVAE (https://link.springer.com/chapter/10.1007/978-3-030-01418-6_41)

Language:PythonGPL-3.0010

John Bradshaw

010

Example of MAML algorithm on sinusoid functions (coded in Jax).

Language:Jupyter NotebookMIT010

General purpose "functional" utilities for python. Inspired by underscore and lodash

Language:PythonApache-2.0010