From 4754d8ddf24d9a20c9e81aaccd19092dcc064bf0 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Giancarlo=20Dess=C3=AC?= Date: Sat, 9 Apr 2022 00:46:05 +0100 Subject: academic/Gabedit: Added (Graphical UI to computational chemistry) Signed-off-by: Dave Woodfall Signed-off-by: Willy Sudiarto Raharjo --- academic/Gabedit/README | 8 ++++++++ 1 file changed, 8 insertions(+) create mode 100644 academic/Gabedit/README (limited to 'academic/Gabedit/README') diff --git a/academic/Gabedit/README b/academic/Gabedit/README new file mode 100644 index 0000000000000..289199d0b7cfb --- /dev/null +++ b/academic/Gabedit/README @@ -0,0 +1,8 @@ +Gabedit is a graphical user interface to computational chemistry +packages like deMon2k, Gamess-US, Gaussian, Molcas, Molpro, MPQC, +MOPAC, Orca, PCGamess and Q-Chem. + +It can display a variety of calculation results including support for +most major molecular file formats. The advanced "Molecule Builder" +allows to rapidly sketch in molecules and examine them in 3D. Graphics +can be exported to various formats, including animations. -- cgit v1.2.3