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2015-siggraph-convolutional-ot

J. Solomon, F. de Goes, G. Peyré, M. Cuturi, A. Butscher, A. Nguyen, T. Du, L. Guibas. Convolutional Wasserstein Distances: Efficient Optimal Transportation on Geometric Domains. ACM Transactions on Graphics (Proc. SIGGRAPH 2015), 34(4), pp. 66:1–66:11, 2015

architect

Architect is a Jekyll theme for GitHub Pages

atomate

atomate is a powerful software for computational materials science and contains pre-built workflows.

awesome-equivariant-network

Paper list for equivariant neural network

blondegeek.github.io

catsoop

CAT-SOOP is an Automatic Tutor for Six-Oh-One Problems

cayman

Cayman is a Jekyll theme for GitHub Pages

clusterscripts

shell, python, and fortran scripts that I use on nersc and lbl clusters

cosmicray

cosmic ray chandeliers -- mixed medium science art installation at MIT (2011)

crystaltoolkit

Crystal Toolkit is an interactive web app that allows you to import, view, analyze and transform crystal structures and molecules. It is also a suite of ready-made UI components to render Materials Project data using the Dash framework from Plotly.

dash-network

D3 force-layout network diagram for Dash

dftk.jl

Density-functional toolkit

docs

Materials Project Documentation

e3nn

A modular framework for neural networks with Euclidean symmetry

e3nn_little

e3nn_protein_examples

e3nn_symm_breaking

Code repository for "Finding symmetry breaking order parameters with Euclidean Neural Networks"

e3nn_tutorial

repository and website for tutorials on 3d Euclidean equivariant neural networks

ferroelectric_search_site

fireworks

The Fireworks Workflow Management Repo.

flask_table

Because writing HTML is fiddly and all of your tables are basically the same

flatsurf

flatten 3d triangulated surfaces to 2d

harmonicconvolutions

Deep Translation and Rotation Equivariance

hyperopt

Distributed Asynchronous Hyperparameter Optimization in Python

icml18-jtnn

Junction Tree Variational Autoencoder for Molecular Graph Generation (ICML 2018)

indigo

Universal cheminformatics libraries, utilities and database search tools

kerfluffle

larflow

LArFlow: predicting pixel correspondence between planes using CNNs

lie_learn

Computations involving Lie groups and harmonic analysis

lingo-website