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votca package

votca 2023-1 source package in Ubuntu

Changelog

votca (2023-1) unstable; urgency=medium

  * New upstream release.
    - SONAME bump to 2023.
    - Remove tutorial-spce-py3.patch, resolved upstream.
    - Builds with Boost 1.83.  (Closes: #1056008)

 -- Nicholas Breen <email address hidden>  Fri, 17 Nov 2023 18:23:36 -0800

Upload details

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

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File Size SHA-256 Checksum
votca_2023-1.dsc 2.7 KiB 0914d08d212479fe8b4409fa7b92cdb9c49013523188d40134da5d2062f1e9b4
votca_2023.orig.tar.gz 37.2 MiB 6150a38c77379d05592a56ae4392a00c4636d02198bb06108a3dc739a45115f8
votca_2023-1.debian.tar.xz 200.9 KiB 6539f0c50ce4ea8953157e7bf544451bab1d4783f2a15b85cf615c065ba10d7b

Available diffs

No changes file available.

Binary packages built by this source

libvotca-2023: VOTCA molecular dynamics analysis - shared libraries

 Versatile Object-Oriented Toolkit for Coarse-Graining Applications (VOTCA)
 is a modeling package for the analysis of molecular dynamics data, the
 development of systematic coarse-graining techniques, and methods used for
 simulating microscopic charge transport in disordered semiconductors.
 .
 libvotca contains VOTCA's coarse-graining and excitation transport
 libraries.

libvotca-2023-dbgsym: debug symbols for libvotca-2023
libvotca-dev: VOTCA molecular dynamics analysis - development files

 Versatile Object-Oriented Toolkit for Coarse-Graining Applications (VOTCA)
 is a modeling package for the analysis of molecular dynamics data, the
 development of systematic coarse-graining techniques, and methods used for
 simulating microscopic charge transport in disordered semiconductors.
 .
 This package contains header files and pkg-config files and templates
 for VOTCA programs.

votca: Molecular dynamics analysis - coarse-graining and charge transport

 Versatile Object-Oriented Toolkit for Coarse-Graining Applications (VOTCA)
 is a modeling package for the analysis of molecular dynamics data, the
 development of systematic coarse-graining techniques, and methods used for
 simulating microscopic charge transport in disordered semiconductors.
 .
 Numerous molecular dynamics packages, including but not limited to
 GROMACS, ESPREesSo, and LAMPPS, can be used together with VOTCA.
 .
 This package contains user programs for the coarse-graining toolkit (CSG)
 and excitation transport toolkit (XTP).

votca-data: VOTCA molecular dynamics analysis - basis sets and scripts

 Versatile Object-Oriented Toolkit for Coarse-Graining Applications (VOTCA)
 is a modeling package for the analysis of molecular dynamics data, the
 development of systematic coarse-graining techniques, and methods used for
 simulating microscopic charge transport in disordered semiconductors.
 .
 This package contains architecture independent coarse-graining scripts
 and basis sets.

votca-dbgsym: debug symbols for votca
votca-tutorials: VOTCA molecular dynamics analysis - tutorials

 Versatile Object-Oriented Toolkit for Coarse-Graining Applications (VOTCA)
 is a modeling package for the analysis of molecular dynamics data, the
 development of systematic coarse-graining techniques, and methods used for
 simulating microscopic charge transport in disordered semiconductors.
 .
 This package contains architecture independent tutorials.