Information for build atomes-1.1.12-1.ocs23
| ID | 7430 | ||||||||||||||||||||||||||
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| Package Name | atomes | ||||||||||||||||||||||||||
| Version | 1.1.12 | ||||||||||||||||||||||||||
| Release | 1.ocs23 | ||||||||||||||||||||||||||
| Epoch | |||||||||||||||||||||||||||
| Source | git+https://gitee.com/opencloudos-stream/atomes.git?.#af3ab1678fab0388fc28ec46504fcf8f0c21dde2 | ||||||||||||||||||||||||||
| 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. | ||||||||||||||||||||||||||
| Built by | fanjunkong | ||||||||||||||||||||||||||
| State | complete | ||||||||||||||||||||||||||
| Volume | DEFAULT | ||||||||||||||||||||||||||
| Started | Wed, 08 May 2024 15:46:32 CST | ||||||||||||||||||||||||||
| Completed | Wed, 08 May 2024 15:50:32 CST | ||||||||||||||||||||||||||
| Task | build (dist-ocs23-epol9, /opencloudos-stream/atomes.git:.:origin/master) | ||||||||||||||||||||||||||
| Extra | {'source': {'original_url': 'git+https://gitee.com/opencloudos-stream/atomes.git?.#origin/master'}} | ||||||||||||||||||||||||||
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| Changelog | * Thu Apr 11 2024 OpenCloudOS Release Engineering <releng@opencloudos.tech> - 1.1.12-1 - initial build |
