| Name : atomes
| |
| Version : 1.1.12
| Vendor : Fedora Project
|
| Release : 1.fc39
| Date : 2023-09-11 12:03:20
|
| Group : Unspecified
| Source RPM : atomes-1.1.12-1.fc39.src.rpm
|
| Size : 9.32 MB
| |
| Packager : Fedora Project
| |
| Summary : An atomistic toolbox
|
Description :
Atomes: a toolbox to analyze, to visualize
and to create/edit three-dimensional atomistic models.
It offers a workspace that allows to have 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.
|
RPM found in directory: /vol/rzm3/linux-fedora-buffet/fedora/linux/releases/39/Everything/x86_64/os/Packages/a |
