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Machine Learning Resources, Practice and Research
Optimized Generative Adversarial Network with Graph Convolutional Networks for Novel Molecule Design
Implementation of AGDIFF: Attention-Enhanced Diffusion for Molecular Geometry Prediction
Toolbox for molecular animations in Blender, powered by Geometry Nodes.
Jupyter book and content for "Machine Learning for Molecular Dynamics" course
A free, open-source tool for modeling chemical reaction networks in Python
ML-based molecular representation models using PyTorch
project-3-mpi-p2p-team-8 created by GitHub Classroom
Unlock your displays on your Mac! Flexible HiDPI scaling, XDR/HDR extra brightness, virtual screens, DDC control, extra dimming, PIP/streaming, EDID override and lots more!
project-2-pi-by-mpi-team-8 created by GitHub Classroom
project-1-team-8 created by GitHub Classroom
An application for configuring and running simulations with OpenMM
A new logP predictor method using GSG and NNs
Parameter/topology editor and molecular simulator
Vue2 && Vue3 Component for resize and drag elements
This repository is a curated collection of links to various courses and resources about Artificial Intelligence (AI)
IYTE Master's Thesis LaTeX Template
Build a deep learning workstation from scratch (HW & SW).
A dependency-free cross-platform swiss army knife for PDB files.
The project has been migrated to @wolf-table/table https://github.com/wolf-table/table
👊 An easy-to-use Spreadsheet in Vue.js 👊
oxpig / Paragraph
Forked from lewis-chinery/ParagraphAntibody paratope prediction using Graph Neural Networks with minimal feature vectors
🖥 Control your display's brightness & volume on your Mac as if it was a native Apple Display. Use Apple Keyboard keys or custom shortcuts. Shows the native macOS OSDs.
An open set of tools for automating tasks relating to small molecules
A batteries-included toolkit for the GPU-accelerated OpenMM molecular simulation engine.
Weighted Ensemble simulation framework in Python
A monospaced programming font inspired by the Minecraft typeface