Factual package intelligence from PyPI

MD2NMR 0.0.8 package intelligence

Tools for calculating NMR relaxation observables (R1/R2/NOE/T1/T2/Tau_c) directly from MD trajectories. Initially written for calculations regarding nucleosome simulations but can be extended for other proteins/complexes.

pip install md2nmr

Current version
0.0.8
Python requirement
Not declared
License
Not declared
Distribution type
Pure Python wheel
Release files
2 (1 wheels, 1 source)
Download size
5.5 KiB
Release history
7 releases with files
Median release cadence
8 days

MD2NMR dependencies

PyPI declares 7 unique dependency rules for this release. Environment markers are shown when supplied by the project.

  1. numpy <3.0,>=1.21
  2. pandas <3.0,>=1.3
  3. scikit-learn <2.0,>=1.0
  4. scipy <2.0,>=1.7
  5. MDAnalysis <3.0,>=2.8
  6. matplotlib <4.0,>=3.4
  7. setuptools >=61.0

Compatibility and release files

MD2NMR publishes 1 wheel and 1 source archive for version 0.0.8. Wheel platform tags: any.

No version-specific Python classifiers are declared.

Metadata completeness

PyPI does not currently declare: Python requirement, license. PyDeps marks these fields as unknown instead of guessing values.

Release activity and sources

PyPI lists 7 releases with files. The first dated release is ; 2 releases fall within the 365 days preceding the latest dated release. The current release files were uploaded on . The preceding dated release was .