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Metal binding prediction using coevolution

Jupyter Notebook 14 3 Updated May 19, 2024

DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design

Python 280 39 Updated Apr 17, 2024

cancer immunology & computational biology

9 Updated Dec 6, 2023

Protein-Ligand Benchmark Dataset for Free Energy Calculations

Python 139 15 Updated Jul 29, 2024

Benchmark set for relative free energy calculations.

89 31 Updated May 22, 2024

This is a theme for Sphinx. It was inspired by the Guzzle theme, but has diverged quite a bit.

SCSS 4 1 Updated May 31, 2024

The Sphinx documentation generator

Python 6,265 2,049 Updated Jul 31, 2024

Sphinx themes ("stanford" and "neo-rtd") based on readthedocs.org

CSS 8 4 Updated Jan 9, 2017

🎞 字幕文件批量改名工具 | Subtitle File Batch Renaming Tool with One-Click Automation and Intelligence

C# 630 27 Updated Jul 6, 2024

PyAutoFEP: an automated FEP workflow for GROMACS integrating enhanced sampling methods

Python 153 74 Updated Sep 22, 2023

Alchemical mutation scoring map

Python 31 11 Updated Jul 18, 2024

Toolkit for free-energy calculation setup/analysis and biomolecular structure handling

Python 128 49 Updated Jul 5, 2024

One has no future if one couldn't teach themself.

Jupyter Notebook 15,136 16,306 Updated Jul 22, 2024

Zhejiang University Graduation Thesis LaTeX Template

TeX 2,496 597 Updated May 1, 2024
Python 47 22 Updated Jun 24, 2024

A development branch of the VMD plugin to analyze NAMD's free energy calculations

Tcl 2 3 Updated Oct 25, 2023

the simple alchemistry library

Python 187 49 Updated Jul 28, 2024

A tool for setting up free energy simulations.

Python 34 18 Updated Oct 20, 2022
Python 9 9 Updated May 17, 2021

将Typora伪装成LaTeX的中文样式主题,本科生轻量级课程论文撰写的好帮手。This is a theme disguising Typora into Chinese LaTeX style.

SCSS 4,645 307 Updated Jul 21, 2024

A feature-rich command-line audio/video downloader

Python 78,215 6,125 Updated Jul 31, 2024

哔哩哔哩常用API调用。支持视频、番剧、用户、频道、音频等功能。原仓库地址:https://github.com/MoyuScript/bilibili-api

Python 2,014 180 Updated Jul 27, 2024

✈️The commend client of ssr based Python3

978 241 Updated Nov 3, 2023

⭐ Linux / Windows / macOS 跨平台 V2Ray 客户端 | 支持 VMess / VLESS / SSR / Trojan / Trojan-Go / NaiveProxy / HTTP / HTTPS / SOCKS5 | 使用 C++ / Qt 开发 | 可拓展插件式设计 ⭐

C++ 16,549 3,261 Updated Jun 29, 2024

A platform for building proxies to bypass network restrictions.

Go 45,096 8,947 Updated Jul 11, 2024

Ship of Theseus

C# 6,977 1,131 Updated Jul 30, 2024

Thesis template without cover for B.S. candidates in XJTU.

TeX 15 5 Updated Jun 11, 2022

GB/T 7714-2015 BibTeX Style

TeX 1 Updated Feb 27, 2017

A GB/T 7714-2005 national standard compliant BibTeX style.

TeX 350 65 Updated Jun 2, 2024
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