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Metal binding prediction using coevolution

Jupyter Notebook 16 3 Updated May 19, 2024

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

Python 297 42 Updated Apr 17, 2024

cancer immunology & computational biology

9 Updated Dec 6, 2023

Protein-Ligand Benchmark Dataset for Free Energy Calculations

Python 144 15 Updated Jul 29, 2024

Benchmark set for relative free energy calculations.

92 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 6,468 2,103 Updated Oct 10, 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 | Batch Rename Subtitle Files to Match Video Names with One Click

C# 701 29 Updated Oct 1, 2024

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

Python 160 74 Updated Sep 22, 2023

Alchemical mutation scoring map

Python 33 11 Updated Jul 18, 2024

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

Python 131 50 Updated Aug 20, 2024

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

Jupyter Notebook 15,223 16,438 Updated Jul 22, 2024

Zhejiang University Graduation Thesis LaTeX Template

TeX 2,567 602 Updated Sep 6, 2024
Python 47 23 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 195 49 Updated Oct 6, 2024

A tool for setting up free energy simulations.

Python 34 18 Updated Oct 20, 2022
Python 9 8 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 4,765 309 Updated Oct 2, 2024

A feature-rich command-line audio/video downloader

Python 84,386 6,577 Updated Oct 7, 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 2,140 203 Updated Oct 7, 2024

✈️The commend client of ssr based Python3

976 239 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++ 16,645 3,258 Updated Sep 3, 2024

A platform for building proxies to bypass network restrictions.

Go 45,346 8,943 Updated Sep 10, 2024

Ship of Theseus

C# 6,987 1,138 Updated Oct 8, 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 352 65 Updated Jun 2, 2024
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