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Search: mole Β· clear

tw93 / Mole

🐹 Keep your Mac and PC clean, light, and running like new. Fast open-source CLI, plus native Mac and Windows apps.

β–² ~1.3k/7d β˜… 72k Shell today
samolego / Canta

Uninstall any Android app without root (with power of Shizuku). Debloat your device as you wish, with Android app or even from your browser!

β–² ~35/7d β˜… 6.3k Kotlin 8d ago
RosettaCommons / foundry

Central repository for biomolecular foundation models with shared trainers and pipeline components

β–² ~21/7d β˜… 1.0k Python 5d ago
caezium / burrow

🐹 Cleanup, app management, maintenance, disk analysis, and live status in one free, open-source, native Mac app + extensive support for AI agents.

β–² ~14/7d β˜… 1.6k Swift today
OpenChemistry / avogadrolibs

Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

β–² ~14/7d β˜… 692 C++ today
hik0w / TiktokPatchXposed

LSPosed module for TikTok: no ads, downloads in any quality, auto-scroll everywhere, hide elements, accent color, own font and AMOLED theme, comment translation, region spoofing, invisible mode and auto streaks. Settings live inside TikTok.

β–² ~14/7d β˜… 47 Java 1d ago
molefrog / wouter

πŸ₯’ A minimalist-friendly ~2.2KB routing for React and Preact

β–² ~7/7d β˜… 7.9k TypeScript 16d ago
lammps / lammps

Public development project of the LAMMPS MD software package

β–² ~7/7d β˜… 3.1k C++ today
milvus-io / bootcamp

Dealing with all unstructured data, such as reverse image search, audio search, molecular search, video analysis, question and answer systems, NLP, etc.

β–² ~7/7d β˜… 2.4k Jupyter Notebook today
bytedance / Protenix

Toward High-Accuracy Open-Source Biomolecular Structure Prediction.

β–² ~7/7d β˜… 2.1k Python 1mo ago
epam / ketcher

Web-based molecule sketcher

β–² ~7/7d β˜… 915 TypeScript today
aqlaboratory / openfold-3

A fully open source biomolecular structure prediction model based on AlphaFold3

β–² ~7/7d β˜… 900 Python today
ansible / molecule

An ansible-native testing framework for collections, playbooks, and roles with configurable workflows for testing any system or service

β–² ~0/7d β˜… 4.2k Python today
apache / guacamole-server

The Apache Guacamole proxy daemon (guacd), C API (libguac), and protocol support.

β–² ~0/7d β˜… 4.0k C 5d ago
chemprop / chemprop

Message Passing Neural Networks for Molecule Property Prediction

β–² ~0/7d β˜… 2.5k Python today
cashapp / molecule

Build a StateFlow stream using Jetpack Compose

β–² ~0/7d β˜… 2.2k Kotlin 1d ago
deepmodeling / deepmd-kit

A deep learning package for many-body potential energy representation and molecular dynamics

β–² ~0/7d β˜… 2.1k Python today
openmm / openmm

OpenMM is a toolkit for molecular simulation using high performance GPU code.

β–² ~0/7d β˜… 2.0k C++ 5d ago
materialsproject / pymatgen

Python 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 Project.

β–² ~0/7d β˜… 2.0k Python 2d ago
apache / guacamole-client

The Apache Guacamole web application, official extensions, and JavaScript library.

β–² ~0/7d β˜… 1.7k Java 7d ago
MDAnalysis / mdanalysis

MDAnalysis is a Python library to analyze molecular dynamics simulations.

β–² ~0/7d β˜… 1.7k Python 1d ago
steedos / steedos-platform

The AI-Native Infrastructure for Enterprise Apps. Powered by ObjectStack (ObjectQL, ObjectOS, Object UI). Turn Prompts into Enterprise Software.

β–² ~0/7d β˜… 1.6k TypeScript 2d ago
iamolegga / nestjs-pino

Platform agnostic logger for NestJS based on Pino with REQUEST CONTEXT IN EVERY LOG

β–² ~0/7d β˜… 1.5k TypeScript 1d ago
axmolengine / axmol

Open-source C++ game engine with Lua for 2D and 3D games across mobile, desktop, WebAssembly, and Xbox (UWP).

β–² ~0/7d β˜… 1.5k C++ 1d ago
molstar / molstar

A comprehensive macromolecular library

β–² ~0/7d β˜… 1.0k TypeScript today
biotite-dev / biotite

A comprehensive library for computational molecular biology

β–² ~0/7d β˜… 978 Python 4d ago
gromacs / gromacs

Public/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use https://gitlab.com/gromacs/gromacs for code review and issue tracking.

β–² ~0/7d β˜… 971 C++ today
mir-group / nequip

NequIP is a code for building E(3)-equivariant interatomic potentials

β–² ~0/7d β˜… 970 Python 2d ago
MolecularAI / REINVENT4

AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.

β–² ~0/7d β˜… 880 Python 8d ago
kyegomez / Open-AF3

Implementation of Alpha Fold 3 from the paper: "Accurate structure prediction of biomolecular interactions with AlphaFold3" in PyTorch

β–² ~0/7d β˜… 808 Python 9d ago
BioPandas / biopandas

Working with molecular structures in pandas DataFrames

β–² ~0/7d β˜… 758 Python 4d ago
mdtraj / mdtraj

An open library for the analysis of molecular dynamics trajectories

β–² ~0/7d β˜… 738 Python 7d ago
nwchemgit / nwchem

NWChem: Open Source High-Performance Computational Chemistry

β–² ~0/7d β˜… 627 Fortran 13d ago
charnley / rmsd

Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format

β–² ~0/7d β˜… 581 Python 25d ago
3dem / relion

Image-processing software for cryo-electron microscopy

β–² ~0/7d β˜… 561 C++ 6d ago
chemosim-lab / ProLIF

Interaction Fingerprints for protein-ligand complexes and more

β–² ~0/7d β˜… 550 Python 12d ago
CGATOxford / UMI-tools

Tools for handling Unique Molecular Identifiers in NGS data sets

β–² ~0/7d β˜… 549 Python 17d ago
lajosdeme / mole

A deep-research agent with an enforced budget, verified quotes, and a privacy boundary for local data.

β–² ~0/7d β˜… 317 Go 8d ago
niclasvestlund-YT / vibepulse

ESP32-S3 AMOLED for Claude Code & Codex usage, live agent activity, and answerable NEEDS YOU alerts. Local-first macOS/Windows host; optional encrypted relays.

β–² ~0/7d β˜… 212 C 2d ago
coleygroup / shepherd2

ShEPhERD-2 code: Interaction Profiles as a Universal Language for Generative Molecular Design

β–² ~0/7d β˜… 61 Python 1mo ago
curisama / The-Badge

Firmware for the Waveshare ESP32-S3-Touch-AMOLED-1.75C β€” a round 466Γ—466 AMOLED badge. BLE trackpad and air mouse, clock, timer, recorder, games, fidgets. Builds and runs on a PC too.

β–² ~0/7d β˜… 56 C 16d ago
K-Dense-AI / drug-discovery-agent-skills

Agent Skills for small-molecule and protein therapeutics: cheminformatics, molecular ML, docking and dynamics, protein design platforms, and target-discovery knowledge graphs.

β–² ~0/7d β˜… 45 Python 3d ago
khlebobul / esp_ble_finder

findphone on a Waveshare ESP32-S3-Touch-AMOLED-1.8 β€” hunt nearby BLE by RSSI, dotted UI, parking-sensor clicks

β–² ~0/7d β˜… 40 C 1mo ago

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