- Jul 30, 2015
-
-
Giovanni Bussi authored
-
Giovanni Bussi authored
-
Giovanni Bussi authored
Lattice reduction is used in plumed to convert box to its "least skewed" form. I changed a bit the threashold since it was giving problems with high optimization flags. Additionally, I added some warning when too many iterations are performed (which indicates a numerical issue)
-
Giovanni Bussi authored
reduced precision to make them work with stronger optimizations
-
- Jul 29, 2015
-
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
It seems that sometime on travis a regtest with mw-mpi crashes. I think this is because when using multiple processors per walker there is a problem in the opening of the old file (for read) and its backup (for write). Adding this barrier seems to make it more robust
-
- Jul 24, 2015
-
-
Giovanni Bussi authored
Get_count() should return the number of element only when used on a Recv status. In this regtests we were probing the value of a Isend status. Likely openmpi sets it anyway as the number of sent element, but this makes mpich2 fail the regtest. I thus removed the check.
-
Giovanni Bussi authored
It seems in 865d16c9 I introduced a bug: checks where reported to travis only when building doc. Fixed now
-
- Jul 23, 2015
-
-
Giovanni Bussi authored
[makedoc]
-
- Jul 20, 2015
-
-
Giovanni Bussi authored
Using "_" instead of "-" to avoid clashes. Actually, the problem was that doing make install PLUMED_SUFFIX=2 make install The second install would have canceled the executables installed by the first install. This is because install assumes names such as plumed-* to be scripts installed for cross compiling
-
- Jul 17, 2015
-
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
There was an error in passing masses from NAMD to PLUMED. Found by Glen Hocky. Fixes #162
-
- Jul 07, 2015
-
-
Giovanni Bussi authored
-
Giovanni Bussi authored
to doxygen 1.8.7
-
Carlo Camilloni authored
-
Carlo Camilloni authored
-
Carlo Camilloni authored
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
When MPI was requested and not found configure was erroneously reporting that PLUMED was compiled with MPI support
-
Giovanni Bussi authored
\issue{123} to get #123 and a link at the github issue page \branch{v2.1} to get v2.1 and a link at the github branch page
-
Giovanni Bussi authored
In 311f3e0b I forgot to rename the link in Cambridge tutorial
-
- Jul 06, 2015
-
-
Giovanni Bussi authored
I removed the sentence saying that 2.2 will crash. We should likely make it fail on travis-ci so that we remember to add the documentation, but I cannot do it know as one regtest basic/rt44b in v2.2 would fail.
-
- Jul 02, 2015
-
-
Giovanni Bussi authored
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
This should show "master" instead of "2.3" in online doc-master
-
- Jul 01, 2015
-
-
Giovanni Bussi authored
-
Giovanni Bussi authored
-
Giovanni Bussi authored
Includes statistics of (style) warnings. Can be used to see if the number of warnings decreases.
-
Giovanni Bussi authored
[makedoc] closes #147
-
Giovanni Bussi authored
-
Giovanni Bussi authored
[makedoc] closes #141
-
- Jun 30, 2015
-
-
Giovanni Bussi authored
Before fix the master branch was installed Now we explicitly ask for 1.69
-
Giovanni Bussi authored
Now $HOME/opt has the priority. This allows properly overriding already installed programs.
-
Giovanni Bussi authored
-
Giovanni Bussi authored
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
-
- Jun 26, 2015
-
-
Giovanni Bussi authored
[makedoc]
-
Giovanni Bussi authored
[makedoc]
-