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Gabedit is a graphical interface for the FireFly, Gamess-US, Gaussian, Molcas, Molpro, MPQC, NWChem, OpenMopac, ORCA, and Q-Chem computational chemistry packages. It includes a 3D molecule editor and viewer. Most major molecular file formats are supported, and graphics can be exported in many formats.

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2008-07-20 08:47 Back to release list
2.1.8

小错误固定。 Gabedit幼儿发展的频谱可以借鉴。您可以导出OpenGL窗口中的EPS，聚苯乙烯，PDF格式，或SVG文件。用户可以更改坐标（在某某编辑），债券，角度和diherdral（在一个Z -矩阵编辑器）直接从编辑列表。 Gabedit可以创建几个轨道只要按一下幻灯片。在Unix下，用户可以运行，不受任何见上脚本变化见上。 Gabedit可以加载从mopac输出文件的每股收益收费如果有可用。
标签: Minor bugfixes
Minor bugs were fixed. Gabedit can draw ECD spectrum. You can export the OpenGL window in an EPS, PS, PDF, or SVG file. The user can change the coordinates (in an XYZ editor), bond, angle, and diherdral (in a Z-matrix editor) directly from the list of the editor. Gabedit can create slides for several orbitals with one click. Under Unix, the user can run gamess without any changes to the scripts of gamess. Gabedit can load the EPS charges from a mopac output file if one is available.

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