Tcl-ChemShell
| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
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About the Tcl-ChemShell category
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0 | 266 | 13 September 2022 |
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Umbrella sampling using Tcl-ChemShell
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0 | 107 | 7 August 2024 |
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Error when reading .c file
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0 | 212 | 12 July 2024 |
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QM/MM Geometry Optimization Error in ORCA Interface
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0 | 427 | 17 June 2024 |
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Unusual point charges in charge shifting method
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1 | 259 | 9 May 2024 |
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Problems compiling tcl-chemshell
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0 | 351 | 24 April 2024 |
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Error in running hybrid qm/mm calculation in tcl-chemshell
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0 | 225 | 22 March 2024 |
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Unable to install tcl-chemshell(v3.7.1)
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3 | 315 | 28 February 2024 |
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Dealing with dummy atoms from Amber in ChemShell
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0 | 494 | 14 July 2023 |
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Parallel build validation of Tcl-Chemshell
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3 | 473 | 2 June 2023 |
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Frequency calculations
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0 | 453 | 25 May 2023 |
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Bash: chemsh: command not found
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2 | 410 | 6 January 2023 |
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Gradient calculation in Tcl-ChemShell
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2 | 444 | 3 November 2022 |