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Versatile downloader for audio, video, podcasts, PDFs and more. Available as CLI and Docker | 多功能下载工具，支持音视频、播客、PDF等，提供 CLI 和 Docker 两种方式
A curated collection of fun and creative examples generated with Nano Banana & Nano Banana Pro🍌, Gemini-2.5-flash-image based model. We also release Nano-consistent-150K openly to support the commu…
Interface for AutoDock, molecule parameterization
A lightweight, cross-platform remote desktop software with support for Web Client access | 一款支持 Web 客户端访问的轻量级跨平台远程桌面软件。
An Agentic Framework for Reflective PowerPoint Generation
Adobe illustrator 科研组图插件，支持复制粘贴相对位置、图片一键自动排列，一键添加子图label | Adobe Illustrator plugin, specifically designed for scientific illustration, supports copy-pasting with relative positioning, batch settin…
PPT plugin, supports one-click to add image titles, copy and paste positions, one-click image alignment, and one-click to insert Markdown (including bold, hyperlinks, and other inline styles, as we…
moldrug (AKA mouse) is a Python package for drug-oriented optimization on the chemical space
Supporting Information for "Prediction of Organic Compound Aqueous Solubility Using Interpretable Machine Learning"
A snakemake-based workflow for FEP and MM(PB/GB)SA calculations with GROMACS
Free Parametrization for Small Molecules
Official Github for "PharmacoNet: deep learning-guided pharmacophore modeling for ultra-large-scale virtual screening" (Chemical Science)
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An interoperable Python framework for biomolecular simulation.
Predict the binding affinity of protein-protein complexes from structural data
Code for visualizing residue wise distribution of binding energy
MaSIF- Molecular surface interaction fingerprints. Geometric deep learning to decipher patterns in molecular surfaces.
LABind: Identifying Protein Binding Ligand-Aware Sites via Learning Interactions Between Ligand and Protein
Tutorial using PLANTS (Protein-Ligand ANTSystem)
Integration of MMGBSA Scoring into the PLANTS Docking Algorithm
scripts to work with PLANTS docking software and its output
Parallel Molecular Docking using PLANTS software