Bug#1022157: ITP: python-mpiplus -- Python GPU framework for alchemical free energy calculations
Package: wnpp
Owner: Andrius Merkys <merkys@debian.org>
Severity: wishlist
* Package name : python-mpiplus
Version : 0.0.1
Upstream Author : Chodera Lab
* URL : https://github.com/choderalab/mpiplus
* License : Expat
Programming Lang: Python
Description : Python GPU framework for alchemical free energy
calculations
GPU-accelerated Python framework for exploring algorithms for alchemical
free energy calculations.
python-mpiplus is needed to package openmmtools.
Remark: This package is to be maintained with Debian Science Maintainers
at https://salsa.debian.org/science-team/python-mpiplus
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