maeparser-1.3.1-1.ocs23 | Build Info

Information for build maeparser-1.3.1-1.ocs23

8382

Package Name

maeparser

Version

1.3.1

Release

1.ocs23

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

Wed, 08 May 2024 22:02:19 CST

Completed

Wed, 08 May 2024 22:06:14 CST

Task

build (dist-ocs23-epol9, /opencloudos-stream/maeparser.git:.:origin/master)

Extra

{'source': {'original_url': 'git+https://gitee.com/opencloudos-stream/maeparser.git?.#origin/master'}}

Tags

dist-ocs23

dist-ocs23-epol9

epol9-test-compose

RPMs

src
	maeparser-1.3.1-1.ocs23.src.rpm (info) (download)
aarch64
	maeparser-1.3.1-1.ocs23.aarch64.rpm (info) (download)
	maeparser-devel-1.3.1-1.ocs23.aarch64.rpm (info) (download)
	maeparser-debuginfo-1.3.1-1.ocs23.aarch64.rpm (info) (download)
	maeparser-debugsource-1.3.1-1.ocs23.aarch64.rpm (info) (download)
x86_64
	maeparser-1.3.1-1.ocs23.x86_64.rpm (info) (download)
	maeparser-devel-1.3.1-1.ocs23.x86_64.rpm (info) (download)
	maeparser-debuginfo-1.3.1-1.ocs23.x86_64.rpm (info) (download)
	maeparser-debugsource-1.3.1-1.ocs23.x86_64.rpm (info) (download)

Logs

x86_64
	installed_pkgs.log
	build.log
	state.log
	hw_info.log
	root.log
	mock_output.log
aarch64
	root.log
	state.log
	installed_pkgs.log
	hw_info.log
	build.log
	mock_output.log

Changelog

* Fri Apr 12 2024 OpenCloudOS Release Engineering <releng@opencloudos.tech> - 1.3.1-1 - initial build

Main Site Links:

Information for build maeparser-1.3.1-1.ocs23