Hongkee Yoon's repositories
abipy
Open-source library for analyzing the results produced by ABINIT
config-1
configuration
e3nn
A modular framework for neural networks with Euclidean symmetry
egnn-pytorch
Implementation of E(n)-Equivariant Graph Neural Networks, in Pytorch
emmet
Be a master builder of databases of material properties. Avoid the Kragle.
equiformer-pytorch
Implementation of the Equiformer, SE3/E3 equivariant attention network that reaches new SOTA, and adopted for use by EquiFold for protein folding
FreeU
FreeU: Free Lunch in Diffusion U-Net
GradDFT
GradDFT is a JAX-based library enabling the differentiable design and experimentation of exchange-correlation functionals using machine learning techniques.
ktx-macro
ktx 취소표 예약 도구 - chrome extension
MXMNet
Source code for our paper "Molecular Mechanics-Driven Graph Neural Network with Multiplex Graph for Molecular Structures"
nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
NeuralQuantum.jl
Neural-Network representation of Quantum Systems
NNPOps
High-performance operations for neural network potentials
ocp
https://opencatalystproject.org/
PhysNet
Code for training PhysNet models
Samsung-AI-Challenge-for-Scientific-Discovery
🥇Samsung AI Challenge 2021 1등 솔루션입니다🥇
se3-transformer-public
code for the SE3 Transformers paper: https://arxiv.org/abs/2006.10503
SpookyNet
Reference implementation of "SpookyNet: Learning force fields with electronic degrees of freedom and nonlocal effects"
srtmacro
매진된 SRT 승차권 예매를 도와주는 크롬 확장 프로그램
tensorflow
An Open Source Machine Learning Framework for Everyone
torchmd-net
Neural network potentials based on graph neural networks and equivariant transformers
vit-pytorch
Implementation of Vision Transformer, a simple way to achieve SOTA in vision classification with only a single transformer encoder, in Pytorch