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atomes package

atomes 1.1.17-1build1 source package in Ubuntu

Changelog

atomes (1.1.17-1build1) questing; urgency=medium

  * No-change rebuild for libxml2 soname change.

 -- Matthias Klose <email address hidden>  Wed, 21 May 2025 10:06:24 +0200

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Uploaded by:
Matthias Klose
Uploaded to:
Questing
Original maintainer:
Debichem Team
Architectures:
any all
Section:
science
Urgency:
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Questing release universe misc

Downloads

File Size SHA-256 Checksum
atomes_1.1.17.orig.tar.gz 5.0 MiB cb04fa3e4d76c43163459f2f9808bf0fc5d501acb72c6a4316661542b995e0e2
atomes_1.1.17-1build1.debian.tar.xz 14.1 KiB dee30fdd3a5f51cdb9c1e5aed15c8cf0ded6219497eabecd24b70d5634f2e5e2
atomes_1.1.17-1build1.dsc 2.2 KiB 866f4c9f01eb9a6a1d9fbbd96e79f834b1a4d9b8440a5aee579389871332bfe0

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Binary packages built by this source

atomes: atomic-scale 3D modeling toolbox

 Atomes is a tool box to analyze (physico-chemical properties calculations),
 visualize (atoms, bonds, colormaps, measurements, coordination polyedra ...)
 create (crystal builder, molecular library, surface creation and
 passivation ...) 3D atomistic models.
 Atomes offers a workspace capable of handling many projects opened
 simultaneously.
 The different projects in the workspace can exchange data: analysis results,
 atomic coordinates...
 Atomes also provides an advanced input preparation system for further
 calculations using well known molecular dynamics codes:
 Classical MD: DLPOLY and LAMMPS
  - ab-initio MD: CPMD and CP2K
  - QM-MM MD: CPMD and CP2K
 To prepare the input files for these calculations is likely to be the key, and
 most complicated step towards MD simulations.
 Atomes offers a user-friendly assistant to help and guide the scientist step
 by step to achieve this crucial step.
 .
 This package provides the binaries.

atomes-data: atomic-scale 3D modeling toolbox (data)

 Atomes is a tool box to analyze (physico-chemical properties calculations),
 visualize (atoms, bonds, colormaps, measurements, coordination polyedra ...)
 create (crystal builder, molecular library, surface creation and
 passivation ...) 3D atomistic models.
 Atomes offers a workspace capable of handling many projects opened
 simultaneously.
 The different projects in the workspace can exchange data: analysis results,
 atomic coordinates...
 Atomes also provides an advanced input preparation system for further
 calculations using well known molecular dynamics codes:
 Classical MD: DLPOLY and LAMMPS
  - ab-initio MD: CPMD and CP2K
  - QM-MM MD: CPMD and CP2K
 To prepare the input files for these calculations is likely to be the key, and
 most complicated step towards MD simulations.
 Atomes offers a user-friendly assistant to help and guide the scientist step
 by step to achieve this crucial step.
 .
 This package contains data files for atomes.

atomes-dbgsym: debug symbols for atomes