git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13399 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
@ -698,13 +698,18 @@ class Packages:
|
|||||||
def setup(self):
|
def setup(self):
|
||||||
|
|
||||||
# extract package lists from src/Makefile
|
# extract package lists from src/Makefile
|
||||||
# remove kokkos from lib since it doesn't actually have a lib
|
# remove names from lib that there are not Make.py lib-classes for
|
||||||
|
# most don't actually have libs, so nothing to control from Make.py
|
||||||
|
|
||||||
make = MakeReader("%s/Makefile" % dir.src)
|
make = MakeReader("%s/Makefile" % dir.src)
|
||||||
std = make.getvar("PACKAGE")
|
std = make.getvar("PACKAGE")
|
||||||
user = make.getvar("PACKUSER")
|
user = make.getvar("PACKUSER")
|
||||||
lib = make.getvar("PACKLIB")
|
lib = make.getvar("PACKLIB")
|
||||||
|
lib.remove("kim")
|
||||||
lib.remove("kokkos")
|
lib.remove("kokkos")
|
||||||
|
lib.remove("molfile")
|
||||||
|
lib.remove("python")
|
||||||
|
lib.remove("quip")
|
||||||
all = std + user
|
all = std + user
|
||||||
|
|
||||||
# plist = command line args expanded to yes-package or no-package
|
# plist = command line args expanded to yes-package or no-package
|
||||||
|
|||||||
@ -279,7 +279,7 @@ FixAveChunk::FixAveChunk(LAMMPS *lmp, int narg, char **arg) :
|
|||||||
if (modify->fix[ifix]->peratom_flag == 0)
|
if (modify->fix[ifix]->peratom_flag == 0)
|
||||||
error->all(FLERR,
|
error->all(FLERR,
|
||||||
"Fix ave/chunk fix does not calculate per-atom values");
|
"Fix ave/chunk fix does not calculate per-atom values");
|
||||||
if (argindex[i] && modify->fix[ifix]->size_peratom_cols != 0)
|
if (argindex[i] == 0 && modify->fix[ifix]->size_peratom_cols != 0)
|
||||||
error->all(FLERR,
|
error->all(FLERR,
|
||||||
"Fix ave/chunk fix does not calculate a per-atom vector");
|
"Fix ave/chunk fix does not calculate a per-atom vector");
|
||||||
if (argindex[i] && modify->fix[ifix]->size_peratom_cols == 0)
|
if (argindex[i] && modify->fix[ifix]->size_peratom_cols == 0)
|
||||||
|
|||||||
@ -328,7 +328,7 @@ FixAveSpatial::FixAveSpatial(LAMMPS *lmp, int narg, char **arg) :
|
|||||||
if (modify->fix[ifix]->peratom_flag == 0)
|
if (modify->fix[ifix]->peratom_flag == 0)
|
||||||
error->all(FLERR,
|
error->all(FLERR,
|
||||||
"Fix ave/spatial fix does not calculate per-atom values");
|
"Fix ave/spatial fix does not calculate per-atom values");
|
||||||
if (argindex[i] && modify->fix[ifix]->size_peratom_cols != 0)
|
if (argindex[i] == 0 && modify->fix[ifix]->size_peratom_cols != 0)
|
||||||
error->all(FLERR,
|
error->all(FLERR,
|
||||||
"Fix ave/spatial fix does not calculate a per-atom vector");
|
"Fix ave/spatial fix does not calculate a per-atom vector");
|
||||||
if (argindex[i] && modify->fix[ifix]->size_peratom_cols == 0)
|
if (argindex[i] && modify->fix[ifix]->size_peratom_cols == 0)
|
||||||
|
|||||||
Reference in New Issue
Block a user