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Commit 07693dc5 authored by Giovanni Bussi's avatar Giovanni Bussi
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Merge branch 'v2.0' into v2.1

parents b17a0ed2 32682faf
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...@@ -19,9 +19,20 @@ function plumed_after_revert(){ ...@@ -19,9 +19,20 @@ function plumed_after_revert(){
} }
function plumed_patch_info(){ function plumed_patch_info(){
echo "" cat << EOF
echo "PLUMED can be incorporated into gromacs using a simple patching procedure."
echo "Patching must be done _after_ gromacs has been configured but _before_ gromacs is compiled" PLUMED can be incorporated into gromacs using the standard patching procedure.
echo Patching must be done in the gromacs source directory _after_ gromacs has been configured but _before_ gromacs is compiled.
echo "For more information on gromacs you should visit http://www.gromacs.org" Gromcas should be configured with ./configure (not cmake).
To enable PLUMED in a gromacs simulation one should use
mdrun with an extra -plumed flag. The flag can be used to
specify the name of the PLUMED input file, e.g.:
mdrun -plumed plumed.dat
For more information on gromacs you should visit http://www.gromacs.org
EOF
} }
...@@ -6,9 +6,18 @@ function plumed_preliminary_test(){ ...@@ -6,9 +6,18 @@ function plumed_preliminary_test(){
} }
function plumed_patch_info(){ function plumed_patch_info(){
echo "" cat << EOF
echo "PLUMED can be incorporated into gromacs using a simple patching procedure."
echo "Patching must be done _before_ the cmake command is invoked" PLUMED can be incorporated into gromacs using the standard patching procedure.
echo Patching must be done in the gromacs root directory _before_ the cmake command is invoked.
echo "For more information on gromacs you should visit http://www.gromacs.org"
To enable PLUMED in a gromacs simulation one should use
mdrun with an extra -plumed flag. The flag can be used to
specify the name of the PLUMED input file, e.g.:
mdrun -plumed plumed.dat
For more information on gromacs you should visit http://www.gromacs.org
EOF
} }
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