ID | 127304 | ||||||||
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Build | maeparser-1.3.1-6.fc40 | ||||||||
Name | maeparser | ||||||||
Version | 1.3.1 | ||||||||
Release | 6.fc40 | ||||||||
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Arch | src | ||||||||
Draft | False | ||||||||
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 | ||||||||
Build Time | 2024-05-03 20:16:10 GMT | ||||||||
Size | 55.36 KB | ||||||||
b2aa0ac007587166a7c137919e0bc29f | |||||||||
License | MIT | ||||||||
Buildroot | f40-build-99766-5897 | ||||||||
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