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University of Illinois Urbana-Champaign
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Automatic Video Generation from Scientific Papers
Atomistic Line Graph Neural Network https://scholar.google.com/citations?user=9Q-tNnwAAAAJ https://www.youtube.com/@dr_k_choudhary
A Google-Colab Notebook Collection for Materials Design: https://jarvis.nist.gov/
🥢像老乡鸡🐔那样做饭。主要部分于2024年完工,非老乡鸡官方仓库。文字来自《老乡鸡菜品溯源报告》,并做归纳、编辑与整理。CookLikeHOC.
Recommend new arxiv papers of your interest daily according to your Zotero libarary.
Introductory course on the Vienna Ab Initio Simulation Package (VASP) given by Dr. Federico Dattila at the Institute of Chemical Research of Catalonia (ICIQ) during September 2021.
Torch-native, batchable, atomistic simulations.
A GUI client for Windows, Linux and macOS, support Xray and sing-box and others
Computational Materials Science(Book)
NepTrainKit is a Python package for visualizing and manipulating training datasets for NEP.
A community-maintained Python framework for creating mathematical animations.
A Zotero plugin to rename PDF files
Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Schake, Bolz, et al. (2025), https://doi.org/10.1093/nar/gkaf361