jjhelmus / nmrglueLinks
A module for working with NMR data in Python
☆247Updated last week
Alternatives and similar repositories for nmrglue
Users that are interested in nmrglue are comparing it to the libraries listed below
Sorting:
- A Python module for processing NMR spectra.☆33Updated last month
- A python module to import NMR data stored in Bruker / TopSpin, TecMag / NTNMR, Magritek / Kea or Chemagnetics / Spinsight format☆37Updated 3 weeks ago
- Python interface of cpptraj☆184Updated last month
- Conversion tool for molecular simulations☆217Updated last year
- GromacsWrapper wraps system calls to GROMACS tools into thin Python classes (GROMACS 4.6.5 - 2024 supported).☆184Updated 4 months ago
- LOOS: a lightweight object-oriented structure analysis library☆127Updated 2 months ago
- WESTPA: The Weighted Ensemble Simulation Toolkit with Parallelization and Analysis☆209Updated last week
- A primer on software development best practices for computational chemistry☆270Updated 3 years ago
- Python-centric Cookiecutter for Molecular Computational Chemistry Packages☆443Updated 3 weeks ago
- Installable VMD as a python module☆148Updated 7 months ago
- A Python library for NMR simulation☆25Updated last year
- Collective variables library for molecular simulation and analysis programs☆237Updated 3 weeks ago
- Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates☆180Updated 3 weeks ago
- LiveCoMS GROMACS Tutorials Paper☆135Updated 6 years ago
- A hierarchical, component based molecule builder