<html><head></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space; ">Hi Alan,<div><br></div><div>I've fixed that bug yesterday; the fix should be in yesterday's new beta. Thanks for the bug report,</div><div><br></div><div>Sander</div><div><br></div><div><br><div><div>On 31 Jul 2010, at 12:41 , Alan wrote:</div><br class="Apple-interchange-newline"><blockquote type="cite">Hi there,<div><br></div><div>I am trying gmx 4.5 beta on Mac SL 10.6.4 with Fink, doing:</div><div><br></div><div>./configure CPPFLAGS="-I/sw/include" LDFLAGS="-L/sw/lib" --enable-shared --with-gsl --with-x</div>
<div><br></div><div>and then 'make' failed with:</div><div><br></div><div><div>(cd .libs/libgmx.lax/libthread_mpi.a && ar x /Users/alan/Downloads/gromacs-4.5-beta1/src/gmxlib/thread_mpi/.libs/libthread_mpi.a)</div>
<div>cc -dynamiclib -o .libs/libgmx.6.dylib .libs/3dview.o .libs/atomprop.o .libs/bondfree.o .libs/calcgrid.o .libs/calch.o .libs/chargegroup.o .libs/checkpoint.o .libs/confio.o .libs/copyrite.o .libs/disre.o .libs/do_fit.o .libs/enxio.o .libs/ewald_util.o .libs/ffscanf.o .libs/filenm.o .libs/futil.o .libs/gbutil.o .libs/gmx_fatal.o .libs/gmx_sort.o .libs/gmxcpp.o .libs/gmxfio.o .libs/ifunc.o .libs/index.o .libs/inputrec.o .libs/cinvsqrtdata.o .libs/invblock.o .libs/macros.o .libs/orires.o .libs/sparsematrix.o .libs/main.o .libs/maths.o .libs/matio.o .libs/mshift.o .libs/mtop_util.o .libs/mtxio.o .libs/mvdata.o .libs/names.o .libs/network.o .libs/nrama.o .libs/nrjac.o .libs/nrnb.o .libs/pargs.o .libs/pbc.o .libs/pdbio.o .libs/princ.o .libs/rando.o .libs/random.o .libs/gmx_random.o .libs/rbin.o .libs/readinp.o .libs/replace.o .libs/rmpbc.o .libs/shift_util.o .libs/sortwater.o .libs/smalloc.o .libs/statutil.o .libs/sfactor.o .libs/strdb.o .libs/string2.o .libs/symtab.o .libs/topsort.o .libs/tpxio.o .libs/trnio.o .libs/trxio.o .libs/txtdump.o .libs/typedefs.o .libs/viewit.o .libs/warninp.o .libs/wgms.o .libs/wman.o .libs/writeps.o .libs/xdrd.o .libs/xtcio.o .libs/xvgr.o .libs/libxdrf.o .libs/gmx_arpack.o .libs/gmx_matrix.o .libs/dihres.o .libs/tcontrol.o .libs/splitter.o .libs/gmx_cyclecounter.o .libs/gmx_system_xdr.o .libs/md5.o .libs/vmdio.o .libs/vmddlopen.o .libs/sighandler.o .libs/oenv.o .libs/gmxfio_rw.o .libs/gmxfio_asc.o .libs/gmxfio_bin.o .libs/gmxfio_xdr.o .libs/libgmx.lax/libnonbonded.a/nb_free_energy.o .libs/libgmx.lax/libnonbonded.a/nb_generic.o .libs/libgmx.lax/libnonbonded.a/nb_generic_cg.o .libs/libgmx.lax/libnonbonded.a/nb_kernel010.o .libs/libgmx.lax/libnonbonded.a/nb_kernel010_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel020.o .libs/libgmx.lax/libnonbonded.a/nb_kernel030.o .libs/libgmx.lax/libnonbonded.a/nb_kernel030_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel100.o .libs/libgmx.lax/libnonbonded.a/nb_kernel100_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel101.o .libs/libgmx.lax/libnonbonded.a/nb_kernel101_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel102.o .libs/libgmx.lax/libnonbonded.a/nb_kernel102_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel103.o .libs/libgmx.lax/libnonbonded.a/nb_kernel103_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel104.o .libs/libgmx.lax/libnonbonded.a/nb_kernel104_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel110.o .libs/libgmx.lax/libnonbonded.a/nb_kernel110_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel111.o .libs/libgmx.lax/libnonbonded.a/nb_kernel111_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel112.o .libs/libgmx.lax/libnonbonded.a/nb_kernel112_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel113.o .libs/libgmx.lax/libnonbonded.a/nb_kernel113_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel114.o .libs/libgmx.lax/libnonbonded.a/nb_kernel114_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel120.o .libs/libgmx.lax/libnonbonded.a/nb_kernel121.o .libs/libgmx.lax/libnonbonded.a/nb_kernel122.o .libs/libgmx.lax/libnonbonded.a/nb_kernel123.o .libs/libgmx.lax/libnonbonded.a/nb_kernel124.o .libs/libgmx.lax/libnonbonded.a/nb_kernel130.o .libs/libgmx.lax/libnonbonded.a/nb_kernel130_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel131.o .libs/libgmx.lax/libnonbonded.a/nb_kernel131_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel132.o .libs/libgmx.lax/libnonbonded.a/nb_kernel132_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel133.o .libs/libgmx.lax/libnonbonded.a/nb_kernel133_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel134.o .libs/libgmx.lax/libnonbonded.a/nb_kernel134_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel200.o .libs/libgmx.lax/libnonbonded.a/nb_kernel200_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel201.o .libs/libgmx.lax/libnonbonded.a/nb_kernel201_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel202.o .libs/libgmx.lax/libnonbonded.a/nb_kernel202_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel203.o .libs/libgmx.lax/libnonbonded.a/nb_kernel203_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel204.o .libs/libgmx.lax/libnonbonded.a/nb_kernel204_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel210.o .libs/libgmx.lax/libnonbonded.a/nb_kernel210_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel211.o .libs/libgmx.lax/libnonbonded.a/nb_kernel211_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel212.o .libs/libgmx.lax/libnonbonded.a/nb_kernel212_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel213.o .libs/libgmx.lax/libnonbonded.a/nb_kernel213_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel214.o .libs/libgmx.lax/libnonbonded.a/nb_kernel214_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel220.o .libs/libgmx.lax/libnonbonded.a/nb_kernel221.o .libs/libgmx.lax/libnonbonded.a/nb_kernel222.o .libs/libgmx.lax/libnonbonded.a/nb_kernel223.o .libs/libgmx.lax/libnonbonded.a/nb_kernel224.o .libs/libgmx.lax/libnonbonded.a/nb_kernel230.o .libs/libgmx.lax/libnonbonded.a/nb_kernel230_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel231.o .libs/libgmx.lax/libnonbonded.a/nb_kernel231_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel232.o .libs/libgmx.lax/libnonbonded.a/nb_kernel232_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel233.o .libs/libgmx.lax/libnonbonded.a/nb_kernel233_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel234.o .libs/libgmx.lax/libnonbonded.a/nb_kernel234_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel300.o .libs/libgmx.lax/libnonbonded.a/nb_kernel300_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel301.o .libs/libgmx.lax/libnonbonded.a/nb_kernel301_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel302.o .libs/libgmx.lax/libnonbonded.a/nb_kernel302_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel303.o .libs/libgmx.lax/libnonbonded.a/nb_kernel303_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel304.o .libs/libgmx.lax/libnonbonded.a/nb_kernel304_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel310.o .libs/libgmx.lax/libnonbonded.a/nb_kernel310_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel311.o .libs/libgmx.lax/libnonbonded.a/nb_kernel311_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel312.o .libs/libgmx.lax/libnonbonded.a/nb_kernel312_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel313.o .libs/libgmx.lax/libnonbonded.a/nb_kernel313_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel314.o .libs/libgmx.lax/libnonbonded.a/nb_kernel314_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel320.o .libs/libgmx.lax/libnonbonded.a/nb_kernel321.o .libs/libgmx.lax/libnonbonded.a/nb_kernel322.o .libs/libgmx.lax/libnonbonded.a/nb_kernel323.o .libs/libgmx.lax/libnonbonded.a/nb_kernel324.o .libs/libgmx.lax/libnonbonded.a/nb_kernel330.o .libs/libgmx.lax/libnonbonded.a/nb_kernel330_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel331.o .libs/libgmx.lax/libnonbonded.a/nb_kernel331_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel332.o .libs/libgmx.lax/libnonbonded.a/nb_kernel332_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel333.o .libs/libgmx.lax/libnonbonded.a/nb_kernel333_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel334.o .libs/libgmx.lax/libnonbonded.a/nb_kernel334_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel400.o .libs/libgmx.lax/libnonbonded.a/nb_kernel400_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel410.o .libs/libgmx.lax/libnonbonded.a/nb_kernel410_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel420.o .libs/libgmx.lax/libnonbonded.a/nb_kernel430.o .libs/libgmx.lax/libnonbonded.a/nb_kernel430_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_allvsall.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_allvsall_sse2_single.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_allvsallgb.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_allvsallgb_sse2_single.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_c.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_x86_64_sse.o .libs/libgmx.lax/libnonbonded.a/nb_kernel_x86_64_sse_test_asm.o .libs/libgmx.lax/libnonbonded.a/nonbonded.o .libs/libgmx.lax/libselection.a/compiler.o .libs/libgmx.lax/libselection.a/evaluate.o .libs/libgmx.lax/libselection.a/mempool.o .libs/libgmx.lax/libselection.a/params.o .libs/libgmx.lax/libselection.a/parser.o .libs/libgmx.lax/libselection.a/parsetree.o .libs/libgmx.lax/libselection.a/scanner.o .libs/libgmx.lax/libselection.a/scanner_internal.o .libs/libgmx.lax/libselection.a/selection.o .libs/libgmx.lax/libselection.a/selelem.o .libs/libgmx.lax/libselection.a/selhelp.o .libs/libgmx.lax/libselection.a/selmethod.o .libs/libgmx.lax/libselection.a/selvalue.o .libs/libgmx.lax/libselection.a/sm_compare.o .libs/libgmx.lax/libselection.a/sm_distance.o .libs/libgmx.lax/libselection.a/sm_insolidangle.o .libs/libgmx.lax/libselection.a/sm_keywords.o .libs/libgmx.lax/libselection.a/sm_merge.o .libs/libgmx.lax/libselection.a/sm_permute.o .libs/libgmx.lax/libselection.a/sm_position.o .libs/libgmx.lax/libselection.a/sm_same.o .libs/libgmx.lax/libselection.a/sm_simple.o .libs/libgmx.lax/libselection.a/symrec.o .libs/libgmx.lax/libstatistics.a/gmx_statistics.o .libs/libgmx.lax/libstatistics.a/histogram.o .libs/libgmx.lax/libtrajana.a/centerofmass.o .libs/libgmx.lax/libtrajana.a/displacement.o .libs/libgmx.lax/libtrajana.a/indexutil.o .libs/libgmx.lax/libtrajana.a/nbsearch.o .libs/libgmx.lax/libtrajana.a/poscalc.o .libs/libgmx.lax/libtrajana.a/position.o .libs/libgmx.lax/libtrajana.a/trajana.o .libs/libgmx.lax/libthread_mpi.a/barrier.o .libs/libgmx.lax/libthread_mpi.a/collective.o .libs/libgmx.lax/libthread_mpi.a/comm.o .libs/libgmx.lax/libthread_mpi.a/errhandler.o .libs/libgmx.lax/libthread_mpi.a/event.o .libs/libgmx.lax/libthread_mpi.a/group.o .libs/libgmx.lax/libthread_mpi.a/hwinfo.o .libs/libgmx.lax/libthread_mpi.a/list.o .libs/libgmx.lax/libthread_mpi.a/lock.o .libs/libgmx.lax/libthread_mpi.a/once.o .libs/libgmx.lax/libthread_mpi.a/p2p.o .libs/libgmx.lax/libthread_mpi.a/profile.o .libs/libgmx.lax/libthread_mpi.a/pthreads.o .libs/libgmx.lax/libthread_mpi.a/reduce_fast.o .libs/libgmx.lax/libthread_mpi.a/tmpi_init.o .libs/libgmx.lax/libthread_mpi.a/topology.o .libs/libgmx.lax/libthread_mpi.a/type.o -L/sw/lib -lm -msse2 -framework Accelerate -install_name /usr/local/gromacs/lib/libgmx.6.dylib -compatibility_version 7 -current_version 7.0</div>
<div>Undefined symbols:</div><div> "_main", referenced from:</div><div> _tMPI_Thread_starter in tmpi_init.o</div><div> _tMPI_Start_threads in tmpi_init.o</div><div>ld: symbol(s) not found</div><div>collect2: ld returned 1 exit status</div>
<div>make[4]: *** [<a href="http://libgmx.la/">libgmx.la</a>] Error 1</div><div>make[3]: *** [all-recursive] Error 1</div><div>make[2]: *** [all-recursive] Error 1</div><div>make[1]: *** [all] Error 2</div><div>make: *** [all-recursive] Error 1</div>
<div><br></div><div><br></div><div>Any ideas? Thanks,</div><div><br></div><div>Alan</div><br>-- <br>Alan Wilter S. da Silva, D.Sc. - CCPN Research Associate<br>Department of Biochemistry, University of Cambridge. <br>80 Tennis Court Road, Cambridge CB2 1GA, UK.<br>
>><a href="http://www.bio.cam.ac.uk/~awd28">http://www.bio.cam.ac.uk/~awd28</a><<<br>
</div>
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