Name : atomes
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Version : 1.1.12
| Vendor : Fedora Project
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Release : 2.fc37
| Date : 2023-09-28 13:19:59
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Group : Unspecified
| Source RPM : atomes-1.1.12-2.fc37.src.rpm
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Size : 9.36 MB
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Packager : Fedora Project
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Summary : An atomistic toolbox
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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.
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RPM found in directory: /packages/linux-pbone/archive.fedoraproject.org/fedora/linux/updates/37/Everything/x86_64/Packages/a |