- May 03, 2018
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Giovanni Bussi authored
It is not possible to use x2 as a variable. In this case, sqrt of distance won't be computed.
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Giovanni Bussi authored
Actions are now shown in order also when they are more than 10. Perhaps should be cleaned up a bit, but it works.
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- May 02, 2018
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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
Also this after a discussion with @marcodelapierre
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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
thanks to @marcodelapierre
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Giovanni Bussi authored
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Giovanni Bussi authored
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- May 01, 2018
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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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- Apr 30, 2018
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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
valgrind reported usage of this as an uninitialized value, so I set it. However, looking at the code below it looks harmless.
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
This reverts commit 2128bada. Giving false positive in master branch - no idea why and cannot debug it
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Giovanni Bussi authored
This reverts commit 5ba9eb93.
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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
- when using NAMD-like interface, also update the unique list of atoms. - moved g2l out of dd, since it is also needed when not using MPI (in NAMD-like interface) Partly implemented by @hanatok, see #359
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Giovanni Bussi authored
Changed so that start()/stop()/pause() return *this. This allows things like sw.start().stop() Stopwatch can be initialized with the reference to a log. In this case, it logs itself at destruction, provided the log is open. Added Stopwatch::Handler class It allows writing exception safe stopwatches which automatically stop when an exception is caught. Removed unnecessary start/stop in PlumedMain constructor. Simplified interface: Use default arguments instead of multiple functions.
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- Apr 26, 2018
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Giovanni Bussi authored
Notice that files are closed on destructor anyway.
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- Apr 20, 2018
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carlocamilloni authored
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- Apr 18, 2018
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni authored
Fixes #357
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- Apr 16, 2018
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Giovanni Bussi authored
Moved __DATE__ and __TIME__ to config/Config.cpp
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