Stars
MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.
Insert and import citations, bibliographies, notes, and PDF annotations from Zotero into Obsidian.
MACE foundation models (MP, OMAT, Matpes)
High-Performance Symbolic Regression in Python and Julia
An open-source Chinese font derived from Fontworks' Klee One. 一款开源中文字体，基于 FONTWORKS 出品字体 Klee One 衍生。
User-friendly GUI macOS application for Homebrew Casks
ASAP is a package that can quickly analyze and visualize datasets of crystal or molecular structures.
The library for web and native user interfaces.
No fortress, purely open ground. OpenManus is Coming.
🐫 CAMEL: The first and the best multi-agent framework. Finding the Scaling Law of Agents. https://www.camel-ai.org
🦉 OWL: Optimized Workforce Learning for General Multi-Agent Assistance in Real-World Task Automation
A modern, lightweight text editor with a minimalist design.
Compiled binaries and sources of LAMMPS, redistributed by AdvanceSoft Corp.
Code for automated fitting of machine learned interatomic potentials.
Python tool for converting files and office documents to Markdown.
Implement a ChatGPT-like LLM in PyTorch from scratch, step by step
Ab initio simulator for thermal transport and lattice anharmonicity
User-friendly Desktop Client App for AI Models/LLMs (GPT, Claude, Gemini, Ollama...)
Phonon anharmonicity analysis from molecular dynamics
GemNet model in PyTorch, as proposed in "GemNet: Universal Directional Graph Neural Networks for Molecules" (NeurIPS 2021)
Python package built to ease deep learning on graph, on top of existing DL frameworks.
MatterSim: A deep learning atomistic model across elements, temperatures and pressures.
MDAnalysis is a Python library to analyze molecular dynamics simulations.
A pymatgen addon for parsing Quantum ESPRESSO files
3D plotting and mesh analysis through a streamlined interface for the Visualization Toolkit (VTK)