DAMQT 3.2
收藏doi.org2025-03-24 收录
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http://doi.org/10.17632/7mwfftd2x4.4
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资源简介:
New version of program DAMQT for the analysis of molecular electron density and related properties, with new applications including an entirely new 3D viewer based on new OpenGL (3.3 or higher).
The tarball includes a MSwindows installer in the "windows" directory and a manual in PDF format in "doc/manual" directory.
A "samples" directory is included with files coming from different suites for molecular calculations that can be directly processed by DAMQT as commented in the manual.
Installation on Unix systems can be made through cmake as indicated in the manual.
DAMQT程序的新版本,专为分析分子电子密度及其相关性质而设计,新增应用包括基于新OpenGL(3.3或更高版本)的全新3D查看器。该压缩包包含位于“windows”目录中的MSWindows安装程序以及位于“doc/manual”目录中的PDF格式的用户手册。此外,还包括一个“samples”目录,其中包含来自不同分子计算套件的文件,这些文件可以直接由DAMQT处理,具体操作方式请参考手册中的注释。Unix系统的安装可通过手册中指示的cmake进行。
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