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Stars

BIO

生化模型信息化
32 repositories

Open Drug Discovery Toolkit

Python 405 116 Updated Dec 13, 2022

Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking

Python 1 Updated May 6, 2024
Jupyter Notebook 131 35 Updated Oct 27, 2021

Rosetta翻译

5 1 Updated Dec 7, 2022

Joint sequence and structure generation with RoseTTAFold sequence space diffusion

Python 204 26 Updated Jan 9, 2024

Multistrand nucleic acid kinetic simulator

C++ 17 10 Updated Jun 29, 2024

🔧rna-tools: a toolbox to analyze sequences, structures and simulations of RNA (and more) used by RNA CASP, RNA PUZZLES, and me ;-) docs @ http:https://rna-tools.rtfd.io web @ http:https://rna-tools.online

Jupyter Notebook 145 43 Updated May 7, 2024

🎒 Python library to read, write, edit DNA sequences

Python 7 Updated Dec 18, 2022

The Rosetta Bio-macromolecule modeling package.

C++ 82 47 Updated Jul 17, 2024

Jupyter Notebooks for learning the PyRosetta platform for biomolecular structure prediction and design

Jupyter Notebook 448 148 Updated Feb 7, 2024

The ViennaRNA Package

C 288 78 Updated May 21, 2024
Python 3 2 Updated Nov 15, 2016

Compressing protein structures effectively with torsion angles

C++ 146 14 Updated Feb 6, 2024

Custom notebook extension that utilizes a new domain specific language, Chemical Markdown Language (CMDL), to assist in documentation of experiments for small molecule chemistry and polymer chemistry.

TypeScript 10 1 Updated Apr 23, 2024

rdkit scripts making life easier

Python 49 24 Updated May 16, 2024

List of molecular design using Generative AI and Deep Learning

594 83 Updated Jun 17, 2024

Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking

Python 984 241 Updated Jul 16, 2024

SailVina重构增强版

Python 77 35 Updated Apr 21, 2024

Generate PDB files for DNA sequence

Python 1 Updated Sep 23, 2015

A tool for quickly generating DNA origami nanostructures from 3D polyhedral meshes, based on the vHelix Autodesk Maya plugin: http:https://www.vhelix.net/

C++ 3 Updated Apr 12, 2022

(Windows) AMDock: Assisted molecular docking with AutoDock4 and AutoDockVina

Python 56 20 Updated Aug 1, 2022

High-throughput virtual screening towards potential targets of aptamer

Shell 3 Updated Oct 20, 2020

Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2

Python 2,631 485 Updated Jul 17, 2024

Open source code for AlphaFold.

Python 12,138 2,159 Updated Jun 27, 2024

RoseTTAFold2 protein/nucleic acid complex prediction

Python 306 68 Updated Jun 3, 2024

精选了5K+项目,包括机器学习、深度学习、NLP、GNN、推荐系统、生物医药、机器视觉、前后端开发等内容。Selected more than 5000 projects, including machine learning, deep learning, NLP, GNN, recommendation system, biomedicine, machine vision, etc. …

603 86 Updated Jul 14, 2024

Protein and nucleic acid validation service

Perl 56 30 Updated Mar 7, 2024

Standardized data set for machine learning of protein structure

Python 851 131 Updated Nov 18, 2020

A program analyzing 3D protein structures from PDB to generate 2D binding motifs

Python 15 4 Updated Jul 18, 2021

Python workflow for DP5 and DP4 analysis of organic molecules

Python 173 99 Updated Dec 1, 2023