nmr-relax / relax
Molecular dynamics by NMR data analysis (mirror of the relax repository)
☆10Updated 7 months ago
Alternatives and similar repositories for relax:
Users that are interested in relax are comparing it to the libraries listed below
- A parallel molecular docking program based on AutoDock Vina☆19Updated 6 years ago
- python simulation interface for molecular modeling. To cite this software publication: https://www.sciencedirect.com/science/article/pii/…☆13Updated 8 years ago
- Pymol ScrIpt COllection (PSICO)☆58Updated 5 months ago
- Dynamics PyMOL Plugin☆42Updated 9 months ago
- A fully GPU-accelerated molecular dynamics program for the Martini force field☆34Updated last year
- Source code for HOLE program.☆31Updated 5 months ago
- Python code to automatically interact with PDBePISA web server☆10Updated 2 years ago
- Open Source, Mostly just clicking mouse to finish a simulation with Ambertools and OpenMM. It was designed to use locally but another not…☆34Updated 5 months ago
- This is a short tutorial showing how to use both VMD and MDAnalysis to analyse a molecular dynamics simulation of a membrane protein.☆26Updated 4 years ago
- A collection of molecular modelling tools for UCSF Chimera☆17Updated 5 years ago
- analyse PDB files, run molecular-dynamics & analyse trajectories☆61Updated 6 years ago
- volume calculation and segmentation☆26Updated 8 months ago
- Voronota is a software tool for analyzing three-dimensional structures of biological macromolecules using the Voronoi diagram of atomic b…☆27Updated this week
- MapQ is a plugin for UCSF Chimera to calculate Q-scores of an atomic model in a cryoEM map.☆13Updated this week
- LOOS: a lightweight object-oriented structure analysis library☆122Updated 2 months ago
- Common molecule fragments for visualization in Avogadro☆15Updated last week
- Templates for use in preparing articles for the Living Journal of Computational Molecular Sciences (LiveCoMS)☆9Updated 2 years ago
- GaudiMM: A modular optimization platform for molecular design☆32Updated 8 months ago
- A unified and modular interface to homology modelling software☆10Updated last year
- Protein-Protein Docking using Genetic Algorithm☆15Updated 8 months ago
- Command line interface for MDAnalysis☆19Updated 6 months ago
- Pymolsnips is a library of PyMOL scripting language code fragments for several popular text editors.☆41Updated 8 months ago
- 🔍 Fit3D - An application for template-based detection of small structural motifs in protein structures and macromolecular structure data…☆11Updated 6 years ago
- A web based application predicts water solubility of any given chemical compound known or unknown☆11Updated 3 years ago
- MMTSB Tool Set☆31Updated 2 months ago
- LiveCoMS GROMACS Tutorials Paper☆111Updated 5 years ago
- ☆13Updated 6 years ago
- Example files for Colvars module: https://github.com/Colvars/colvars☆13Updated 3 years ago
- Python script that creates 2D protein-ligand interaction images☆14Updated 6 years ago