all options
bookworm-backports  ] [  trixie  ] [  sid  ]
[ Source: atomes  ]

Пакунок: atomes (1.1.14-1.1 and others)

Links for atomes

Screenshot

Debian Resources:

Download Source Package atomes:

Maintainers:

External Resources:

Similar packages:

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.

Інші пакунки пов'язані з atomes

  • depends
  • recommends
  • suggests
  • enhances

Завантажити atomes

Завантаження для всіх доступних архітектур
Архітектура Версія Розмір пакунка Розмір після встановлення Файли
i386 1.1.14-1.1+b1 973.1 kB3,130.0 kB [список файлів]