parmed 4.3.0+dfsg-2 source package in Ubuntu

Changelog

parmed (4.3.0+dfsg-2) unstable; urgency=medium

  * Build depends on python3-versioneer (Closes: #1088136)

 -- Andrius Merkys <email address hidden>  Mon, 25 Nov 2024 04:39:22 -0500

Upload details

Uploaded by:
Debichem Team
Uploaded to:
Sid
Original maintainer:
Debichem Team
Architectures:
any
Section:
misc
Urgency:
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Plucky release universe misc

Downloads

File Size SHA-256 Checksum
parmed_4.3.0+dfsg-2.dsc 2.3 KiB fcf223d6bbc2cdede1eede6e64d24f3f134be078bc900d15b0efa900c688c04d
parmed_4.3.0+dfsg.orig.tar.xz 46.2 MiB 822f1ea346683f816e2a03780fed2dc4b3d1c1362698bd14458ae871968886fb
parmed_4.3.0+dfsg-2.debian.tar.xz 7.1 KiB c37130034199917fd34431d9503297e3150143f8cce20020374017732e8732d3

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Binary packages built by this source

python3-parmed: parameter and topology file editor and molecular mechanical simulator

 ParmEd is a package designed to facilitate creating and easily manipulating
 molecular systems that are fully described by a common classical force field.
 Supported force fields include Amber, CHARMM, AMOEBA, and several others that
 share a similar functional form (e.g., GROMOS).
 .
 ParmEd is capable of reading and writing to a wide array of different file
 formats, like the Amber topology and coordinate files, CHARMM PSF, parameter,
 topology, and coordinate files, Tinker parameter, topology, and coordinate
 files, and many others. The expressive central data structure (the 'Structure'
 class) makes it easy to quickly and safely manipulate a chemical system, its
 underlying topology, and force field parameters describing its potential energy
 function.
 .
 There are two parts of ParmEd -- a documented API that one can incorporate into
 their own Python scripts and programs, and a GUI/CLI pair of programs that
 provides a means to quickly perform various modifications to chemical systems
 for rapid prototyping.
 .
 The API also provides bindings to the OpenMM library, permitting one to carry
 out full molecular dynamics investigations using ParmEd on high-performant
 hardware, like AMD and NVidia GPUs.

python3-parmed-dbgsym: debug symbols for python3-parmed