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Easy-to-Use Molecular Voxelization Tool
OpenPose: Real-time multi-person keypoint detection library for body, face, hands, and foot estimation
A Scanning Tunneling Microscope Project
Official Github for "PharmacoNet: Accelerating Large-Scale Virtual Screening by Deep Pharmacophore Modeling" (NeurIPS 2023 Workshop)
an autoregressive flow model incorporated with chemical acknowledge for generating drug-like molecules inside protein pockets
PointSite: a point cloud segmentation tool for identification of protein ligand binding atoms
POLYGON VAE For de novo Polypharmacology
Official release of the ProGen models
Code for the ProteinMPNN paper
ProtTrans is providing state of the art pretrained language models for proteins. ProtTrans was trained on thousands of GPUs from Summit and hundreds of Google TPUs using Transformers Models.
Code for running RFdiffusion
🦴 Automated Cobb Angle Measurement on Anterior-Posterior Spine X-Rays using Multi-Instance Keypoint Detection with Keypoint RCNN Thesis Package
This is a guide for passing an AMD/NVIDIA GPU to a Windows 10 Guest VM on Linux
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The official implementation of 3D Equivariant Diffusion for Target-Aware Molecule Generation and Affinity Prediction (ICLR 2023)
Thompson Sampling
Uni-Dock: a GPU-accelerated molecular docking program
An automatic workflow to perform MM/GB(PB)SA calculations from force field building, and structure optimization to free energy calculation.
Official Repository for the Uni-Mol Series Methods
Vina-GPU 2.0 accelerates AutoDock Vina and its related commonly derived docking methods, such as QuickVina 2 and QuickVina-W with GPUs.
Vina-GPU 2.1, an improved docking toolkit for faster speed and higher accuracy on the virtual screening
implicit or explicit water model based docking with Autodock vina engine. supporting pharmacophore /position constrained docking
Zinc Database Downloader & Merger
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.