Hi all,
I've been struggling to install parallel c32b2 with gamess-us(the most recent version).
I followed fully the procedure of the install guide in the charmm-gamess-patches(May 11,2006).
Additionally, updated actvte.f in the tool directory and set the TARGET in gmscomp_gnu to linux_ia64.
Then, the installation with
./install.com em64t xxlarge IFORT Q M MPICH
gives the following errors.
These are only a part of lines (seemed to be relevant with compile errors) at the end of em64t.log file.
.....
/usr/local/c32b2/lib/em64t/gamess.a(mcpinp.o)(.text+0x725c): In function `mmpred_':
: undefined reference to `gms_getenv_'
/usr/local/c32b2/lib/em64t/gamess.a(mcpinp.o)(.text+0x76ad): In function `mmpred_':
: undefined reference to `gms_getenv_'
/usr/local/c32b2/lib/em64t/gamess.a(scflib.o)(.text+0x509f): In function `enuc_':
: undefined reference to `chgoct_'
.....
.....
/usr/local/c32b2/lib/em64t/gamess.a(ccddi.o)(.text+0x1b9e4): In function `ddcc_t_iij_big_':
: undefined reference to `ddi_smp_sync_'
/usr/local/c32b2/lib/em64t/gamess.a(ccddi.o)(.text+0x1bc7f): In function `ddcc_t_iij_big_':
: undefined reference to `ddi_smp_sync_'
make: *** [/usr/local/c32b2/exec/em64t/charmm] Error 1
I have no idea what's wrong or missing with this.
Also, I'm wondering whether paral*.src in the patch should be overwritten too to the source/machdep directory.
In that case, things to be added is just about PARHOST and PARHLEN arrays in source/fcm/parallel.fcm?
Please let me know how to solve this problem.
Thanks for your interest and reply in advance.
Seongeun
