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Chemshell Discourse

Topic Replies Views Activity Welcome to the ChemShell forum

1 355 13 September 2022 Parallel build validation of Tcl-Chemshell
Tcl-ChemShell

0 29 4 May 2023 Rate calculations with Py-ChemShell
Py-ChemShell

0 42 4 April 2023 Potential issue with chemsh --debug flag in Py-ChemShell
21.0.2 parallel version
Py-ChemShell

1 116 27 February 2023 Convert cluster object back to cif
Py-ChemShell

1 39 13 February 2023 Bash: chemsh: command not found
Tcl-ChemShell

2 59 6 January 2023 Tool for automatically adding hydrogen atoms to dangling
bonds

1 192 8 November 2022 Gradient calculation in Tcl-ChemShell
Tcl-ChemShell

2 116 3 November 2022 Compiling Py-ChemShell 21.0 without pip
Py-ChemShell

0 122 20 October 2022


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Topic Replies Views Activity

Welcome to the ChemShell forum

This forum is for discussion of the ChemShell multiscale computational chemistry
environment. For more information on the ChemShell project, please visit
www.chemshell.org 1 355 Sep '22 Parallel build validation of Tcl-Chemshell
Tcl-ChemShell
0 29 14d Rate calculations with Py-ChemShell
Py-ChemShell
0 42 4 Apr Potential issue with chemsh –debug flag in Py-ChemShell 21.0.2
parallel version
Py-ChemShell
1 116 27 Feb Convert cluster object back to cif
Py-ChemShell
1 39 13 Feb Bash: chemsh: command not found
Tcl-ChemShell
2 59 6 Jan Tool for automatically adding hydrogen atoms to dangling bonds

1 192 Nov '22 Gradient calculation in Tcl-ChemShell
Tcl-ChemShell
2 116 Nov '22 Compiling Py-ChemShell 21.0 without pip
Py-ChemShell
0 122 Oct '22


THERE ARE NO MORE LATEST TOPICS.






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