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Hi,<br><br>I think you shouldn't enable fortran.<br><br>Berk<br><br>> From: f.affinito@cineca.it<br>> To: gmx-users@gromacs.org<br>> Subject: Re: [gmx-users] error on compilation on BlueGene/P<br>> Date: Mon, 20 Sep 2010 17:50:48 +0200<br>> <br>> ... and if I add the --enable-bluegene flag :<br>> <br>> "../../../../../src/gmxlib/nonbonded/nb_kernel_bluegene/nb_kernel_gen_bluegene.h",<br>> line 163.21: 1506-1231 (S) The built-in function "__fpsub" is not valid<br>> for the target architecture.<br>> <br>> and more similar errors.<br>> <br>> <br>> F.<br>> <br>> On 09/20/2010 05:35 PM, Fabio Affinito wrote:<br>> > Hi all,<br>> > I'm trying to install Gromacs on BG/P following the instruction reported<br>> > here:<br>> > http://www.gromacs.org/Downloads/Installation_Instructions/GROMACS_on_BlueGene<br>> > <br>> > I ran configure:<br>> > ../configure --prefix=/bgp/userinternal/cin0644a/gromacs \<br>> > --enable-ppc-sqrt \<br>> > --disable-ppc-altivec \<br>> > --enable-fortran \<br>> > --with-fft=fftw3 \<br>> > --without-x \<br>> > CFLAGS="-O3 -qarch=auto -qtune=auto" \<br>> > CC="xlc_r -q64" \<br>> > CXX="xlC_r -q64" \<br>> > CXXFLAGS="-O3 -qarch=auto -qtune=auto" \<br>> > CPPFLAGS="-I/bgp/userinternal/cin0644a/fftwlibs/include" \<br>> > F77="xlf_r -q64" \<br>> > FFLAGS="-O3 -qnoprefetch -qarch=auto -qtune=auto" \<br>> > LDFLAGS="-L/bgp/userinternal/cin0644a/fftwlibs/lib"<br>> > <br>> > But when I compile with make I get this error:<br>> > <br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 42.10: 1506-296 (S) #include file "nbkernel010_f77_single.h" not found.<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 43.10: 1506-296 (S) #include file "nbkernel020_f77_single.h" not found.<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 44.10: 1506-296 (S) #include file "nbkernel030_f77_single.h" not found.<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 45.10: 1506-296 (S) #include file "nbkernel100_f77_single.h" not found.<br>> > [...]<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 114.5: 1506-045 (S) Undeclared identifier nbkernel010_f77_single.<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 115.5: 1506-045 (S) Undeclared identifier nbkernel020_f77_single.<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 116.5: 1506-045 (S) Undeclared identifier nbkernel030_f77_single.<br>> > "../../../../../src/gmxlib/nonbonded/nb_kernel_f77_single/nb_kernel_f77_single.c",<br>> > line 117.5: 1506-045 (S) Undeclared identifier nbkernel100_f77_single.<br>> > <br>> > <br>> > Do you have any hint about that?<br>> > <br>> > Thanks in advance!<br>> > <br>> > F.<br>> > <br>> > <br>> <br>> <br>> -- <br>> *********************************************<br>> Fabio Affinito, PhD<br>> CINECA<br>> InterUniversity Computer Center<br>> Via Magnanelli, 6/3<br>> Casalecchio di Reno (Bologna) ITALY<br>> +39/051/6171794 (Phone)<br>> e-mail: f.affinito@cineca.it<br>> -- <br>> gmx-users mailing list gmx-users@gromacs.org<br>> http://lists.gromacs.org/mailman/listinfo/gmx-users<br>> Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting!<br>> Please don't post (un)subscribe requests to the list. Use the <br>> www interface or send it to gmx-users-request@gromacs.org.<br>> Can't post? Read http://www.gromacs.org/Support/Mailing_Lists<br> </body>
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