[gmx-users] Mopac gomacs installation

vidhya sankar scvsankar_agr at yahoo.com
Thu Jul 26 02:51:27 CEST 2012

Dear Gromacs user 

                            I am trying to install Mopac gromacs . i have folloed the instruction as in the web page 

I used the following command 

LIBS=-lmopac   LDFLAGS=-L/usr/local/lib   ./configure  --with-qmmm-mopac --enable-double --program-suffix=_d
It configured successfully 

But when i compile using make command i  Got the follwing error

/root/gromacs-4.5.51/src/mdlib/.libs/libmd.so: undefined reference to `domldt_'
/root/gromacs-4.5.51/src/mdlib/.libs/libmd.so: undefined reference to `domop_'
collect2: ld returned 1 exit
make[3]: *** [grompp] Error 1
make[3]: Leaving directory `/root/gromacs-4.5.51/src/kernel'
make[2]: *** [all-recursive] Error 1
make[2]: Leaving directory `/root/gromacs-4.5.51/src'
make[1]: *** [all] Error 2
make[1]: Leaving directory `/root/gromacs-4.5.51/src'

I have kept in libmolac.a files (pre compiled library files) in usr/local/lib even i used the CPPFLAGS
Does anybody give suggestion about the wrong things that i have done ?
Thanks In advance

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