- Sep 10, 2021
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Mark Abraham authored
Knowing which PLUMED version has patched GROMACS is potentially valuable information for GROMACS and PLUMED users and developers troubleshooting their runs.
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Giovanni Bussi authored
plumed-patch is the script-only version used when cross compiling See 074ce219 See #737
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- Sep 09, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
See #737
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- Aug 31, 2021
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Carlo Camilloni authored
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Carlo Camilloni authored
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Carlo Camilloni authored
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Carlo Camilloni authored
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Carlo Camilloni authored
the energy was not correctly updated if the move was accepted
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- Aug 24, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
- matheval not needed - fftw is already on by default
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- Aug 22, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
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- Aug 19, 2021
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Giovanni authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
I tested by changing --print-prog-name to --print-prog-namex (not existing) so as to reproduce the bug, and this seems to fix it so I merge it.
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- Aug 14, 2021
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Giovanni Bussi authored
See #726
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- Jul 27, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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- Jul 23, 2021
- Jul 22, 2021
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Giovanni Bussi authored
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- Jul 21, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
Can be used for numeric comparisons in precompiler directives
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- Jul 19, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
Error is this one: ../maketools/makelinks.sh: line 24: echo: write error: Broken pipe It's triggered by the comparison with a <(echo) file, since the comparison might fail before echo completes. If this works I will backport it
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- Jul 06, 2021
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Giovanni authored
minor improvements to OPES_METAD
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Michele Invernizzi authored
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- Jul 02, 2021
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Michele Invernizzi authored
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Michele Invernizzi authored
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- Jun 28, 2021
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
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