leopython3

leopython3's Stars

• alyssaxuu/screenity

  The free and privacy-friendly screen recorder with no limits 🎥

  Language:JavaScript12k926

• dptech-corp/Uni-GBSA

  An automatic workflow to perform MM/GB(PB)SA calculations from force field building, and structure optimization to free energy calculation.

  Language:Python9120

• sahakyanhk/iPBSA

  iPBSA minimizes docked receptor-ligand conformations in implicit solvent and calculates the binding free energy with MM/PB(GB)SA methods. The algorithm is based on a freely available AmberTools18 which can be easily installed via conda

  Language:Shell111

• limbopro/Paolujichang

  科学上网🕸️之跑路机场名单收集（2020-2024），欢迎投稿。

  2.3k42

• 2noise/ChatTTS

  A generative speech model for daily dialogue.

  Language:Python31.7k3.4k

• deepmodeling/Uni-Mol

  Official Repository for the Uni-Mol Series Methods

  Language:Python689122

• pharmai/plip

  Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Adasme et al. (2021), https://doi.org/10.1093/nar/gkab294

  Language:Python457106

• openmm/pdbfixer

  PDBFixer fixes problems in PDB files

  Language:Python474114

• Cry1ngMan/1

  ❤️💛💚💙💜　定期更新　❤️💛💚💙💜　免费白嫖　❤️💛💚💙💜　公益节点　❤️💛💚💙💜　机场分享　❤️💛💚💙💜　订阅链接　❤️💛💚💙💜　科学上网　❤️💛💚💙💜　梯子翻墙　❤️💛💚💙💜　谷歌商店　❤️💛💚💙💜　有小火箭　❤️💛💚💙💜　有小猫咪　❤️💛💚💙💜　蓝灯安卓　❤️💛💚💙💜　部署爬取　❤️💛💚💙💜vpn　trojan❤️💛💚💙💜clash　v2ray❤️💛💚💙💜

  2.2k106

• Kohulan/DECIMER-Image_Transformer

  DECIMER: Deep Learning for Chemical Image Recognition using Efficient-Net V2 + Transformer

  Language:Python19751

• GrowingGit/GitHub-Chinese-Top-Charts

  :cn: GitHub中文排行榜，各语言分设「软件 | 资料」榜单，精准定位中文好项目。各取所需，高效学习。

  Language:Java99.6k13.1k

• scanberg/viamd

  Visual Interactive Analysis of Molecular Dynamics

  Language:C++27328

• carbonsilicon-ai/CarsiDock

  Official repo of "CarsiDock: a deep learning paradigm for accurate protein–ligand docking and screening based on large-scale pre-training" proposed by CarbonSilicon AI.

  Language:Python687

• gnina/gnina

  A deep learning framework for molecular docking

  Language:C++615145

• czodrowskilab/VSFlow

  Language:Python8319

• songquanpeng/one-api

  OpenAI 接口管理 & 分发系统，支持 Azure、Anthropic Claude、Google PaLM 2 & Gemini、智谱 ChatGLM、百度文心一言、讯飞星火认知、阿里通义千问、360 智脑以及腾讯混元，可用于二次分发管理 key，仅单可执行文件，已打包好 Docker 镜像，一键部署，开箱即用. OpenAI key management & redistribution system, using a single API for all LLMs, and features an English UI.

  Language:JavaScript18.6k4.2k

• maxscheurer/pycontact

  Analysis of non-covalent interactions in MD trajectories

  Language:Python5112

• HITS-MCM/MD-IFP

  MD trajectory analysis using protein-ligand Interaction Fingerprints

  Language:Jupyter Notebook6218

• wgwang/awesome-LLMs-In-China

  **大模型

  5.4k445

• CharlesHahn/DuIvyTools

  A Tool to process and visualize the results of molecular dynamics simulations(GROMACS).

  Language:Python5810

• YAMACS-SML/YAMACS

  Yasara plugins for Gromacs users

  Language:Python243

• DweipayanG/GROMACS-Protein-Ligand

  Language:Python3625

• vastsa/FileCodeBox

  文件快递柜-匿名口令分享文本，文件，像拿快递一样取文件（FileCodeBox - File Express Cabinet - Anonymous Passcode Sharing Text, Files, Like Taking Express Delivery for Files）

  Language:Python4k490

• RekerLab/DeepDelta

  DeepDelta is a pairwise deep learning approach based on Chemprop that processes two molecules simultaneously and learns to predict property differences between two molecules.

  Language:Python457

• cosconatilab/PyRMD

  AI-powered Virtual Screening

  Language:Python8025

• ATOMScience-org/AMPL

  The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.

  Language:Jupyter Notebook13667

• jiji262/xiaoetong-video-downloader

  小鹅通资源下载工具

  Language:Python23075

• TrionesType/zhuque

  朱雀仿宋/朱雀宋朝/Zhuque Fangsong: An open-source Fangsong typeface project

  Language:Shell2.7k36

• chatanywhere/GPT_API_free

  Free ChatGPT API Key，免费ChatGPT API，支持GPT4 API（免费），ChatGPT国内可用免费转发API，直连无需代理。可以搭配ChatBox等软件/插件使用，极大降低接口使用成本。国内即可无限制畅快聊天。

  Language:Python23.2k1.8k

• xx025/carrot

  Free ChatGPT Site List 这儿为你准备了众多免费好用的ChatGPT镜像站点

  17k1.4k