| Name : aten
| |
| Version : 2.1.6
| Vendor : openSUSE-Education
|
| Release : 150400.1.5
| Date : 2024-06-03 12:41:09
|
| Group : Productivity/Scientific/Chemistry
| Source RPM : aten-2.1.6-150400.1.5.src.rpm
|
| Size : 29.74 MB
| |
| Packager : https://www_suse_com/
| |
| Summary : Atomic configuration builder and editor
|
Description :
Aten provides a clean graphical user interface allowing the intuitive editing
and creation of input coordinates for computational chemistry / physics codes.
It allows periodic (i.e. condensed) and non-periodic (i.e. gas-phase) models
and systems to be created either from scratch or from existing coordinate files.
Molecular mechanics forcefields of standard functional forms may be loaded and
used to minimise existing systems or create (through Monte Carlo techniques)
new multi-component configurations. Periodic systems may be stretched, scaled,
and repeated, and symmetry operators applied. Molecular dynamics trajectories
may be loaded, viewed, frames edited, and properties calculated.
|
RPM found in directory: /packages/linux-pbone/ftp5.gwdg.de/pub/opensuse/repositories/Education/SLE_15_SP4/x86_64 |
