pbenner
Follow
-
-
pycoordinationnet Public
A neural network model for materials property prediction based on coordination environments
-
pymatgen Public
Forked from lutfia95/pymatgenPython Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials …
Python Other UpdatedAug 16, 2025 -
torch-legendre Public
A Legendre Polynomial Layer for PyTorch
Jupyter Notebook MIT License UpdatedAug 14, 2025 -
-
matbench-discovery Public
Forked from janosh/matbench-discoveryAn evaluation framework for machine learning models simulating high-throughput materials discovery.
-
-
SynCoTrain Public
Forked from sasanamari/SynCoTrainCo-Training for Crystal Synthesizability Prediction
Jupyter Notebook MIT License UpdatedOct 15, 2024 -
gonetics Public
Go / Golang Bioinformatics Library
-
mace Public
Forked from ACEsuit/maceMACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.
-
-
-
alignn Public
Forked from usnistgov/alignnAtomistic Line Graph Neural Network
Python Other UpdatedAug 11, 2023 -
-
-
modhmm Public
ModHMM Genome Segmentation Method
-
pyleapfrog Public
Leapfrog regularization for estimating sparse models in PyTorch
Python MIT License UpdatedSep 23, 2022 -
-
double-descent Public
Simple examples of double descent (benign overfitting)
-
lisp-backprop Public
Old implementation of Backpropagation in Lisp
-
-
-
autodiff Public
Autodiff is a numerical library for the Go programming language that supports automatic differentiation. It implements routines for linear algebra (vector/matrix operations), numerical optimization…
-
-
-
-
-
classifierPerformance Public
Program to compute performance measures from predictions of a classifier
Go GNU General Public License v3.0 UpdatedJul 29, 2020 -
-