Stars
An open library for the analysis of molecular dynamics trajectories
Get up and running with Llama 3.3, DeepSeek-R1, Phi-4, Gemma 3, Mistral Small 3.1 and other large language models.
User-friendly AI Interface (Supports Ollama, OpenAI API, ...)
Official implementation of MatterGen -- a generative model for inorganic materials design across the periodic table that can be fine-tuned to steer the generation towards a wide range of property c…
UltraVNC Server, UltraVNC Viewer, UltraVNC Repeater and UltraVNC SC | Official repository: https://github.com/ultravnc/UltraVNC
Deskreen turns any device with a web browser into a secondary screen for your computer. ⭐️ Star to support our work!
Add virtual monitors to your windows 10/11 device! Works with VR, OBS, Sunshine, and/or any desktop sharing software.
Two algorithms to fragment molecules into specified molecular subunits (e.g. functional groups)
Code for Crystal Graph Convolutional Neural Networks
Python client library for Google Maps API Web Services
Python tool for converting files and office documents to Markdown.
Graph Data Augmentation Library for PyTorch Geometric
Prediction molecular structure from NMR spectra
🧪📈 🐍. The purpose of the panel-chemistry project is to make it really easy for you to do DATA ANALYSIS and build powerful DATA AND VIZ APPLICATIONS within the domain of Chemistry using using Python…
RadonPy is a Python library to automate physical property calculations for polymer informatics.
AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.
The easiest library for creating GUIs in Python
Sample code for "Predicting polymer-solvent miscibility using machine-learned Flory-Huggins interaction parameters
A powerful and flexible machine learning platform for drug discovery
Yet Another Upload Release Asset Action
install & import するだけで matplotlib を日本語表示対応させる
書籍「最短コースでわかるPyTorch深層学習プログラミング」用サポートサイト
Create *beautiful* command-line interfaces with Python
Fast calculation of hydrogen-bond strengths and free energy of hydration of small molecules.
Responsive, simple, clean and content-focused Hugo theme based on the MH Magazine lite WordPress theme
🚀 Netlify deploy from GitHub Actions