David Duvenaud's starred repositories
MLAlgorithms
Minimal and clean examples of machine learning algorithms implementations
example-models
Example models for Stan
category-theory
An axiom-free formalization of category theory in Coq for personal study and practical work
molecule-autoencoder
A project to enable optimization of molecules by transforming them to and from a continuous representation.
nips17-rexgen
Predicting Organic Reaction Outcomes with Weisfeiler-Lehman Network (NIPS 2017)
keras-neural-graph-fingerprint
Keras implementation of Neural Graph Fingerprints as proposed by Duvenaud et al., 2015
design_embeddings_jmd_2016
Experiment code associated with our JMD paper: "Design Manifolds Capture the Intrinsic Complexity and Dimension of Design Spaces"
Other_Code
Miscellaneous code
neural_network_tutorials
A repository demonstrating concise, educational machine learning implementations in python
inference_sandbox
A simple sandbox environment build on top of tensorflow for testing variational inference algorithms