pyxmolpp2

Utils for processing MD

Project description

About

C++ and python library to process MD trajectories.

Install

# from pypi
python -m pip install pyxmolpp2

# from github dev branch
python -m pip install git+https://github.com/sizmailov/pyxmolpp2.git@dev

See install page for more details

Documentation

https://sizmailov.github.io/pyxmolpp2/

The documentation includes usage examples and python API reference.

Contribution

Issues and PRs are welcome

License

Software is distributed under MIT license.

Project details

Release history Release notifications | RSS feed

This version

2.0.2

Sep 5, 2023

2.0

Sep 4, 2023

2.0a0 pre-release

Feb 17, 2021

1.6.0

Jul 15, 2020

1.5.3

Jul 14, 2020

1.5.2

Jul 10, 2020

1.5.0

Jul 10, 2020

1.4.0

Jul 9, 2020

1.3.0

Jul 5, 2020

1.2.0

Jul 5, 2020

1.1.0.post1

Jul 2, 2020

1.1.0

Jul 2, 2020

1.1.0.dev0 pre-release

Jul 1, 2020

1.0.0

Jun 29, 2020

1.0.0.dev3 pre-release

Jun 28, 2020

1.0.0.dev1 pre-release

Jun 17, 2020

0.10.4

May 12, 2020

0.10.3

Apr 25, 2020

0.10.2

Oct 29, 2019

0.10.1.post2

Oct 26, 2019

0.10.1.post1

Oct 9, 2019

0.10.0

Oct 8, 2019

0.9.0.post1

Aug 30, 2019

0.9.0

Aug 29, 2019

0.8.2

Jun 30, 2019

0.8.1

May 15, 2019

0.8.0

May 13, 2019

0.7.1

Apr 11, 2019

0.7.0

Apr 9, 2019

0.6.1

Mar 12, 2019

0.6.0

Feb 19, 2019

0.4.0

Nov 14, 2018

0.3.0

Sep 18, 2018

0.3.0.dev1 pre-release

Sep 18, 2018

0.3.0.dev0 pre-release

Sep 18, 2018

0.2.0

Sep 13, 2018

0.1.1

May 14, 2018

0.1.0

May 13, 2018

0.0.1

May 2, 2018

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