A versatile tool to investigate membrane

A simple python script to facilitate the analysis of the MD trajectory of protein-ligand complexes produced by OpenMM and Gromacs.

Cctalk视频下载工具

Cctalk视频下载工具-原项目的重构版本

A PyMOL Plugin for calculating docking box for LeDock, AutoDock and AutoDock Vina.

Helps you write algorithms in PyTorch that adapt to the available (CUDA) memory

Using Low-rank adaptation to quickly fine-tune diffusion models.

Rosetta翻译

Github repository for the LiveCoMS tutorial of the continuous constant pH molecular dynamics method

Gaussian Accelerated Molecular Dynamics Implementation in Gromacs

A Python script that plots radial distribution function (RDF) and coordination number curve from xvg file produced by gromacs.

Official repo of the Biomeccanica Multiscala course (prof. Marco A. Deriu) - Master Degree in Biomedical engineering, Politecnico di Torino

List of scripts that I developed during my work

HTMD: Programming Environment for Molecular Discovery

小鹅通视频课程下载工具，一键下载小鹅通上面已购买的付费课程

小鹅通、学浪、腾讯课堂批量下载器，超适合小白一键式操作，永久免费更新，如果有更好的建议，请联系作者更新

RMD_digging is aimed to provide pre-processing and post-processing tools for the reactive molecular dynamics (ReaxFF) simulations based on MATLAB language, including formatting the reactive force f…

Data and script of Umbrella Sampling for molecular transmembrane