- Dec 11, 2018
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Giovanni Bussi authored
Notice that I had to change to interface of a couple of functions ActionSet:getLabelList() and getLabelVector() adding a template parameter. Should be harmless since these functions were used in a few places only.
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- Mar 12, 2018
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Giovanni Bussi authored
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Giovanni Bussi authored
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- Jun 08, 2017
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Giovanni Bussi authored
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- Jun 06, 2017
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Giovanni Bussi authored
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- May 11, 2017
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Gareth Tribello authored
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- May 04, 2017
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Giovanni Bussi authored
Notice that almost all files were updated with the astyle commit 2813d759 Year in header is here updated to 2017
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- Apr 25, 2017
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Giovanni Bussi authored
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- Apr 21, 2017
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Carlo Camilloni authored
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Giovanni Bussi authored
This is a huge commit, applying indentation to the whole code. Notice that this commit is made on master branch after having merged with -s ours from branch v2.3 See #215
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Giovanni Bussi authored
This is a huge commit, applying indentation to the whole code. See #215
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- Mar 28, 2017
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Giovanni Bussi authored
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- Mar 05, 2017
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Giovanni Bussi authored
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- Jan 08, 2016
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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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- Aug 27, 2014
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Giovanni Bussi authored
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Giovanni Bussi authored
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- Jun 25, 2014
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Giovanni Bussi authored
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- Oct 09, 2013
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Giovanni Bussi authored
I set it to 2 instead of 2.0, so that it will not be necessary to update it
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- Aug 16, 2013
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Davide Branduardi authored
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- Apr 17, 2013
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Giovanni Bussi authored
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- Feb 15, 2013
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Giovanni Bussi authored
Mostly unused variables
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- Dec 17, 2012
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Giovanni Bussi authored
I replaced all the "using namespace PLMD" statements with explicit namespace PLMD{ …… }. This is more clear and simplify the syntax for defining operators
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- Dec 06, 2012
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Giovanni Bussi authored
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- Nov 23, 2012
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Giovanni Bussi authored
All the source code have been moved into subdirectories of src/ Some of these subdirectories are treated in a special manner: src/wrapper contains the wrappers for MD codes src/main contains the main.cpp file src/config contains files generated without compilation, just based on configuration info src/lib is the place where executables and libraries are put at the end src/cltools contains the command line tools src/tools contains plumed tools (reusable classes) src/basic contains PlumedMain, Action hierarchy and other basic stuff src/multicolvar contains MultiColvar stuff src/imd is the interactive MD (still not totally portable). Notice that, to allow easy inclusion of .h files from other modules, I link all the directories in src/ into module directory. In this way it is possible e.g. to write #include "config/PlumedConfig.h" See src/README and src/basic/Makefile to understand how inter-module dependencies are set
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- Jul 21, 2012
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davidebr authored
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- Jul 20, 2012
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Giovanni Bussi authored
as suggested by Gareth
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- Jul 19, 2012
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Giovanni Bussi authored
I added a PEOPLE file containing list of authors and a script (src/header.sh) which applies the Licence to all the source files. It can be applies multiple times (it automatically deletes the present header and replace it with the new one). Thus, to change the header, edit header.sh and execute it.
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- Jul 21, 2011
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Giovanni Bussi authored
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- Jun 30, 2011
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Giovanni Bussi authored
I added some stricter check for deallocations of Atoms::Request objects. I also removed the SIGMA keyword from Colvar (the right place would be in Value). Finally, I fixed some lines which were leading to apparent memory leakage with valgrind.
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- Jun 16, 2011
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Giovanni Bussi authored
This is the draft version that I prepared and that we will use as a starting point. Still it is a bit dirty, and I will try to improve documentation and delete unused routines
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