atomes 1.1.12+repack-2ubuntu1 source package in Ubuntu
Changelog
atomes (1.1.12+repack-2ubuntu1) noble; urgency=medium * Drop hardcoded libgtk-3-0 dependency -- Julian Andres Klode <email address hidden> Sat, 23 Mar 2024 19:34:31 +0100
Upload details
- Uploaded by:
- Julian Andres Klode
- Uploaded to:
- Noble
- Original maintainer:
- Ubuntu Developers
- Architectures:
- any all
- Section:
- misc
- Urgency:
- Medium Urgency
See full publishing history Publishing
Series | Published | Component | Section |
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Downloads
File | Size | SHA-256 Checksum |
---|---|---|
atomes_1.1.12+repack.orig.tar.gz | 3.3 MiB | c9a540d0492f8c6b4d829b7cb8df5fc2fa5cf6374ee4e3c13f90865e9303d143 |
atomes_1.1.12+repack-2ubuntu1.debian.tar.xz | 14.0 KiB | 1b8fa544b2c25ccfb1d3939e43553957b79971eece9ee0cdeae82daae6e774fc |
atomes_1.1.12+repack-2ubuntu1.dsc | 2.3 KiB | b2dd6620e45b26823adddaa91535b2c6d26d3b531f5cef585eb650076b4b5044 |
Available diffs
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