xiaowangfeng's Stars
hjkgrp/MOFSimplify
The MOF website for property prediction and community engagement.
meiirbek-islamov/thermal-transport-MOFs
YKQ98/Matformer
Official code for Periodic Graph Transformers for Crystal Material Property Prediction (NeurIPS 2022)
superlouis/GATGNN
Pytorch Repository for our work: Graph convolutional neural networks with global attention for improved materials property prediction
usnistgov/alignn
Atomistic Line Graph Neural Network https://scholar.google.com/citations?user=9Q-tNnwAAAAJ&hl=en
materialsvirtuallab/matgl
Graph deep learning library for materials
materialsvirtuallab/megnet
Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals
WangYueFt/dgcnn
dair-ai/ml-visuals
🎨 ML Visuals contains figures and templates which you can reuse and customize to improve your scientific writing.
shap/shap
A game theoretic approach to explain the output of any machine learning model.
leo6862/pointattentionvlad
PointAttentionVLAD : A two-stage self-attenion network for point cloud based place recognition
Andrew-S-Rosen/QMOF
The QMOF Database: A database of quantum-mechanical properties for metal-organic frameworks.
zhuty16/MQSA-TED
This is our Tensorflow implementation for "Collaboration and Transition: Distilling Item Transitions into Multi-Query Self-Attention for Sequential Recommendation." (MQSA-TED) WSDM 2024.
MenghaoGuo/PCT
Jittor implementation of PCT:Point Cloud Transformer
JierunChen/FasterNet
[CVPR 2023] Code for PConv and FasterNet
YOLOonMe/EMA-attention-module
Implementation Code for the ICCASSP 2023 paper " Efficient Multi-Scale Attention Module with Cross-Spatial Learning" and is available at: https://arxiv.org/abs/2305.13563v2
xmindflow/Awesome_Mamba
Computation-Efficient Era: A Comprehensive Survey of State Space Models in Medical Image Analysis
YuanbinLiu/GANN
Multiscale Graph Attention Neural Networks for Mapping Materials and Molecules
brain-research/mpnn
Open source implementation of "Neural Message Passing for Quantum Chemistry"
lmy1997/tuxiaoshi
Xiaoxun-Gong/DeepH-E3
deepmodeling/DeepH-pack
Deep neural networks for density functional theory Hamiltonian.
txie-93/cgcnn
Crystal graph convolutional neural networks for predicting material properties.
txie-93/cdvae
An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]
deepmaterials/dlmatreview
https://www.nature.com/articles/s41524-022-00734-6
munrojm/pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
materialsproject/api
New API client for the Materials Project
cal-itp/data-infra
Cal-ITP data infrastructure
googleapis/google-cloud-go
Google Cloud Client Libraries for Go.
google-deepmind/materials_discovery