- Oct 12, 2016
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Carlo Camilloni authored
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Carlo Camilloni authored
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Carlo Camilloni authored
[makedoc]
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Giovanni Bussi authored
[makedoc]
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Giovanni Bussi authored
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- Oct 11, 2016
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Carlo Camilloni authored
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Giovanni Bussi authored
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Giovanni Bussi authored
When there are zero atoms in one of the DD domains, some arrays are allocated to be zero sized and later accessed with &array[0]. Whereas this is harmless, it triggers an out-of-boundary error when plumed is compiled with --enable-debug-glibcxx The size of those arrays is now guaranteed to be at least 1.
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Carlo Camilloni authored
[makedoc]
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Carlo Camilloni authored
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Carlo Camilloni authored
[makedoc]
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- Oct 09, 2016
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Giovanni Bussi authored
[makedoc]
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Giovanni Bussi authored
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Giovanni Bussi authored
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Giovanni Bussi authored
[makedoc]
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Giovanni Bussi authored
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Giovanni Bussi authored
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- Oct 06, 2016
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Carlo Camilloni authored
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Carlo Camilloni authored
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Carlo Camilloni authored
[makedoc]
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Carlo Camilloni authored
[makedoc]
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Carlo Camilloni authored
[makedoc]
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Carlo Camilloni authored
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Carlo Camilloni authored
[makedoc]
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Carlo Camilloni authored
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- Oct 05, 2016
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Giovanni Bussi authored
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Giovanni Bussi authored
When using METAD with file-based multiple walkers and many processes launched with mpirun (e.g. with gromacs -multi) replica suffix is not added to grid file. (see also 667da1b3) Contributed by Marco De La Pierre
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Carlo Camilloni authored
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Carlo Camilloni authored
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Giovanni Bussi authored
[makedoc]
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Giovanni Bussi authored
This now allows the following things: - include the bias applied by PLUMED in the LAMMPS total energy - allows for multiple walkers using MPI This patch was provided by @PabloPiaggi
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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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- Oct 04, 2016
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Giovanni Bussi authored
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Giovanni Bussi authored
This reverts commit 564bd00f. (useless)
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- Oct 03, 2016
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Giovanni Bussi authored
[makedoc]
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Giovanni Bussi authored
When making mistakes such as STRIDE=2.5 or COORDINATION NN=6.5 It gives an error instead of using the default values. This fixes #104
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Giovanni Bussi authored
This finds a keyword in a list without erasing it.
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