spyrmsdkit๏ƒ

๐Ÿ–‹๏ธ Authors: spyrmsdkit authors
๐Ÿ  Project home: https://github.com/RMeli/spyrmsdkit/
๐Ÿ“– Documentation: https://spyrmsd.readthedocs.io
โš–๏ธ License: GPL-2.0-or-later
๐Ÿ”‘ Keywords: spyrmsd, RMSD, symmetry-corrected RMSD, drug discovery
๐Ÿš€ Development status: Production
๐Ÿ“‘ Publications:
๐Ÿงช Tests (latest): spyrmsdkit develop CI status
๐Ÿงช Tests (develop): spyrmsdkit develop CI status
Description:
spyrmsdkit allows to compute symmetry-corrected RMSDs with spyrmsd on MD trajectories

Installation instructions๏ƒ

The source code of spyrmsdkit can be installed using the following:

pip install git+https://github.com/RMeli/spyrmsdkit@main