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updates to use new funcs from Python as well

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This commit is contained in:
Steve Plimpton
2022-04-14 10:49:12 -06:00
parent bc2b600f09
commit 5c70f45feb
2 changed files with 35 additions and 12 deletions
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13
src/MDI/fix_mdi_aimd.cpp
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@ -110,21 +110,24 @@ int FixMDIAimd::setmask()
void FixMDIAimd::init()
{
if (mdicomm != MDI_COMM_NULL) return;
// one-time initialization of mdicomm
// plugin = 0/1 if MDI engine is a stand-alone code vs plugin library
// one-time auto-detect whether engine is stand-alone code or plugin library
// also initializes mdicomm
// plugin = 0/1 for engine = stand-alone code vs plugin library
MDI_Get_communicator(&mdicomm,0);
if (mdicomm == MDI_COMM_NULL) {
plugin = 0;
MDI_Accept_communicator(&mdicomm);
if (mdicomm <= 0) error->all(FLERR,"Unable to connect to MDI engine");
if (mdicomm == MDI_COMM_NULL)
error->all(FLERR,"MDI unable to connect to stand-alone engine");
} else {
plugin = 1;
int method;
MDI_Get_method(&method,mdicomm);
if (method != MDI_PLUGIN) error->all(FLERR,"MDI internal error");
if (method != MDI_PLUGIN)
error->all(FLERR,"MDI internal error for plugin engine");
}
}