On May 23, 2011, at 4:24 PM, [email protected] wrote:

Re: Gromacs Installation Error on Powerbook G$ Running    OS
     10.5.8



Hi Justin. Thanks for you response. See my responses below, embedded in the original message:
Matthew Bick wrote:


Dear Gromacs community.  I am attempting to install the latest version
of Gromcs (4.5.4) on my Mac Powerbook G4 (1.67 MHz, OS 10.5.8).  I
have successfully installed FFTW following the instructions provided
on the Gromacs installation page.

"./configure --with-fft=fftw3" appears to work properly, but when I
perform  "Make" I get the following errors:

ld: symbol(s) not found
collect2: ld returned 1 exit status
make[4]: *** [libgmx.la] Error 1
make[3]: *** [all-recursive] Error 1
make[2]: *** [all-recursive] Error 1
make[1]: *** [all] Error 2
make: *** [all-recursive] Error 1


|The information about the actual missing symbols should be just above this |output, so that would be useful information. Also pertinent would be the |compiler versions you're using. From what you've posted below it looks like
|GCC, but which version?

I am using the latest Developer's tools for Leopard 10.5.8. So that comes with gcc 4.0 and 4.2. I can't say for certain which version was used during configuration. I do know that when 'configuration'
        looks for gcc it finds it.

    Here are the missing symbols, plus the error codes once again:

        Undefined symbols:
         "___sync_lock_test_and_set", referenced from:
         _tMPI_Lock_trylock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Lock_lock in lock.o
         _tMPI_Type_commit in type.o
         _tMPI_Type_contiguous in type.o
         "___sync_bool_compare_and_swap", referenced from:
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_detach in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_push in list.o
         _tMPI_Stack_pop in list.o
         _tMPI_Once_wait in once.o
         _tMPI_Once in once.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Prep_send_envelope in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Wait_process_incoming in p2p_protocol.o
         _tMPI_Wait_process_incoming in p2p_protocol.o
         _tMPI_Wait_process_incoming in p2p_protocol.o
         _tMPI_Wait_process_incoming in p2p_protocol.o
         "___sync_fetch_and_add", referenced from:
         _tMPI_Once_wait in once.o
         "___sync_lock_release", referenced from:
         _tMPI_Lock_unlock in lock.o
         _tMPI_Type_commit in type.o
         _tMPI_Type_contiguous in type.o
         "___sync_add_and_fetch", referenced from:
         _tMPI_Alltoallv in alltoall.o
         _tMPI_Alltoall in alltoall.o
         _tMPI_Barrier_wait in barrier.o
         _tMPI_Mult_recv in collective.o
         _tMPI_Mult_recv in collective.o
         _tMPI_Post_multi in collective.o
         _tMPI_Post_multi in collective.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Xfer in p2p_protocol.o
         _tMPI_Xfer in p2p_protocol.o
         _tMPI_Wait_process_incoming in p2p_protocol.o
         _tMPI_Reduce_fast in reduce.o
         _tMPI_Reduce_fast in reduce.o
         _tMPI_Scatterv in scatter.o
         _tMPI_Scatter in scatter.o
         "___sync_synchronize", referenced from:
         _tMPI_Alltoallv in alltoall.o
         _tMPI_Alltoallv in alltoall.o
         _tMPI_Alltoall in alltoall.o
         _tMPI_Alltoall in alltoall.o
         _tMPI_Barrier_wait in barrier.o
         _tMPI_Barrier_wait in barrier.o
         _tMPI_Mult_recv in collective.o
         _tMPI_Mult_recv in collective.o
         _tMPI_Post_multi in collective.o
         _tMPI_Post_multi in collective.o
         _tMPI_Post_multi in collective.o
         _tMPI_Event_wait in event.o
         _tMPI_Lock_islocked in lock.o
         _tMPI_Once_wait in once.o
         _tMPI_Once_wait in once.o
         _tMPI_Once_wait in once.o
         _tMPI_Post_send in p2p_protocol.o
         _tMPI_Xfer in p2p_protocol.o
         _tMPI_Reduce_fast in reduce.o
         _tMPI_Reduce_fast in reduce.o
         _tMPI_Scatterv in scatter.o
         _tMPI_Scatterv in scatter.o
         _tMPI_Scatter in scatter.o
         _tMPI_Scatter in scatter.o
     ld: symbol(s) not found
     collect2: ld returned 1 exit status
     make[4]: *** [libgmx.la] Error 1
     make[3]: *** [all-recursive] Error 1
     make[2]: *** [all-recursive] Error 1
     make[1]: *** [all] Error 2
     make: *** [all-recursive] Error 1


|I don't think those warnings are particularly harmful, but I know that trying to |install a new version of Gromacs on PowerPC can be a challenge. If your |compiler is relatively old, you may have to disable some of the newer features, |like threading, although that should have been caught during configuration.

|Is the ./configure command given above the exact command you used? If not,
|posting that would be useful.


      Yes, that ./configure command is the exact command I used.

      Thank you again for any suggestions.  I know everyone is busy.    
        
        -Matt
        


-Justin



I did configure my shell (bash) environment, as per the Gromacs
installation instructions.  "Make" runs for about 10 minutes before I
get these errors.  I have searched the mailing list, and have seen
people report problems similar to mine, but couldn't determine how
those problems were resolved.  Also from the mailing list, I
understand that the errors I've listed above aren't that informative.
If it helps, I repeatedly get the following warnings during "Make":

../../../../include/types/../thread_mpi/atomic/gcc_intrinsics.h: In
function ???tMPI_Atomic_add_return???:
../../../../include/types/../thread_mpi/atomic/gcc_intrinsics.h:46:
warning: implicit declaration of function ???__sync_add_and_fetch???
../../../../include/types/../thread_mpi/atomic/gcc_intrinsics.h: In
function ???tMPI_Atomic_fetch_add???:
../../../../include/types/../thread_mpi/atomic/gcc_intrinsics.h:51:
warning: implicit declaration of function ???__sync_fetch_and_add???
../../../../include/types/../thread_mpi/atomic/gcc_intrinsics.h: In
function ???tMPI_Atomic_cas???:
../../../../include/types/../thread_mpi/atomic/gcc_intrinsics.h:57:
warning: implicit declaration of function
???__sync_bool_compare_and_swap???

If anyone has any suggestions, they would be greatly appreciated.
Thanks.

Matthew Bick
Rockefeller University

--
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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