| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
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Welcome to the ChemShell forum
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1 | 203 | 13 September 2022 |
| Potential issue with chemsh --debug flag in Py-ChemShell 21.0.2 parallel version |
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0 | 13 | 25 November 2022 |
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Tool for automatically adding hydrogen atoms to dangling bonds
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1 | 19 | 8 November 2022 |
| Gradient calculation in Tcl-ChemShell |
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2 | 35 | 3 November 2022 |
| Compiling Py-ChemShell 21.0 without pip |
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0 | 40 | 20 October 2022 |