Information for build maeparser-1.3.1-1.oc9
| ID | 22969 | ||||||||||||||||||||||||||
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| Package Name | maeparser | ||||||||||||||||||||||||||
| Version | 1.3.1 | ||||||||||||||||||||||||||
| Release | 1.oc9 | ||||||||||||||||||||||||||
| Epoch | |||||||||||||||||||||||||||
| Source | git+https://gitee.com/opencloudos-stream/maeparser.git?.#c4a77f8c1681dda70312736c1ba89e10a4cfe4fd | ||||||||||||||||||||||||||
| Summary | A parser for Schrodinger Maestro files | ||||||||||||||||||||||||||
| Description | Maestro is a commercial "all-purpose molecular modeling environment", produced and distributed by the company Schrödinger. Maestro has its own cognate file format, typically associated with the ".mae" file extension. This package provides an open-source parser for the Maestro file format, released and maintained by the Maestro developers. This facilitates a lossless transition from the widely accepted suite of Schrödinger into local custom developments or the open-source world at large. Maeparser handles output from: * Molecular Dynamics applications, such as Desmond and FEP+ * Ligand-Protein Docking applications, such as Glide * Homology Modeling and folding applications, such as Prime * Ligand-based search applications, such as Phase and Phase Shape * Quantum Mechanics applications, such as Jaguar * Protein-Protein Docking applications * ... many other backends used in both Life and Material Sciences | ||||||||||||||||||||||||||
| Built by | fanjunkong | ||||||||||||||||||||||||||
| State | complete | ||||||||||||||||||||||||||
| Volume | DEFAULT | ||||||||||||||||||||||||||
| Started | Mon, 03 Jun 2024 18:03:35 CST | ||||||||||||||||||||||||||
| Completed | Mon, 03 Jun 2024 18:07:11 CST | ||||||||||||||||||||||||||
| Task | build (dist-oc9-epol, /opencloudos-stream/maeparser.git:.:origin/master) | ||||||||||||||||||||||||||
| Extra | {'source': {'original_url': 'git+https://gitee.com/opencloudos-stream/maeparser.git?.#origin/master'}} | ||||||||||||||||||||||||||
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| Changelog | * Fri Apr 12 2024 OpenCloudOS Release Engineering <releng@opencloudos.tech> - 1.3.1-1 - initial build |
