[gmx-users] Call for testing: trajectory analysis framework in Python

Максим Кольцов kolmax94 at gmail.com
Tue May 30 15:07:21 CEST 2017

Hi all,

This project was presented at the last Gromacs Workshop in Germany. We
would like to collect some feedback on usability, features and on
whether it is needed at all before going on with the development.

Shortly: we provide Python wrappers for gromacs Trajectory Analysis
framework as described in the docs. Project is currently hosted on
GitHub: https://github.com/PNPI/gromacs-pyapi
There is a Readme file that should be enough for getting stared. If
not, we are open for questions and clarifications.

This API is intended for fast prototyping and writing one-time
throw-away script to test you ideas on trajectory files.

Looking forward to feedback and bug reports!

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