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Pinned

  1. MDAnalysis is a Python library to analyze molecular dynamics trajectories.

    Python 321 179

  2. A suite of tools to explore protein structures with Protein Blocks 🐍

    Python 15 9

  3. Reads Gromacs EDR file to populate a pandas dataframe

    Python 17 4

  4. Create a bookmarklet that add your academic proxy to journals URL

    CSS 2

  5. INSert membrANE - A simple, versatile tool for building coarse-grained simulation systems

    Python 9 6

  6. Manipulate grace file in python

    Python

385 contributions in the last year

Jul Aug Sep Oct Nov Dec Jan Feb Mar Apr May Jun Jul Mon Wed Fri
Activity overview
Contributed to marrink-lab/vermouth-martinize, jbarnoud/panedr, MDAnalysis/mdanalysis and 5 other repositories
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Contribution activity

July 2019

Created a pull request in westpa/westpa_tutorials that received 1 comment

Fix typos

Fix a missing space after a Å, and a typo in a file name.

+2 −2 1 comment

Created an issue in westpa/westpa_tutorials that received 2 comments

h5py=2.6 is incompatible with westpa-2017.10-py27_0

The "advanced_WExplore" tutorial ask to install "h5py=2.6" as a dependency of the WESTA-WExplore plugin (section 6.4.3). However, conda install h5p…

2 comments

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