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Bug 89969 - gromacs : add gromacs and fftw to ~ppc64
Summary: gromacs : add gromacs and fftw to ~ppc64
Status: VERIFIED FIXED
Alias: None
Product: Gentoo Linux
Classification: Unclassified
Component: Current packages (show other bugs)
Hardware: PPC64 Linux
: High normal (vote)
Assignee: ppc64 architecture team
URL:
Whiteboard:
Keywords:
Depends on:
Blocks:
 
Reported: 2005-04-21 13:34 UTC by Omkhar Arasaratnam (RETIRED)
Modified: 2006-05-07 12:44 UTC (History)
3 users (show)

See Also:
Package list:
Runtime testing required: ---


Attachments
enables USE for altivec (gromacs.diff,841 bytes, patch)
2005-04-29 17:20 UTC, Brent Baude (RETIRED)
Details | Diff
gromacs-altivec.patch (gromacs-altivec.patch,1.11 KB, patch)
2005-04-30 15:25 UTC, Omkhar Arasaratnam (RETIRED)
Details | Diff
gromacs-altivec.patch (gromacs-altivec.patch,667 bytes, patch)
2005-04-30 15:39 UTC, Omkhar Arasaratnam (RETIRED)
Details | Diff
gromacs-cleanup.patch (gromacs-altivec.patch,1.29 KB, patch)
2005-05-01 10:55 UTC, Omkhar Arasaratnam (RETIRED)
Details | Diff

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Description Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-04-21 13:34:59 UTC
I've tested and confirmed that gromacs (and it's dep fftw) compile fine on ppc64 - please add to ~ppc64 for testing

Reproducible: Always
Steps to Reproduce:
Comment 1 Markus Rothe (RETIRED) gentoo-dev 2005-04-27 01:45:24 UTC
this works for you? it breaks for me horribly:

[...]
./../include/ppc_altivec.h:3551: error: parse error before "float"
../../include/ppc_altivec.h:3552: error: `v7' undeclared (first use in this function)
../../include/ppc_altivec.h:3552: error: parse error before "float"
../../include/ppc_altivec.h:3553: error: `v8' undeclared (first use in this function)
../../include/ppc_altivec.h:3553: error: parse error before "float"
../../include/ppc_altivec.h:3554: error: `v9' undeclared (first use in this function)
../../include/ppc_altivec.h:3554: error: parse error before "float"
mpicc: No such file or directory
make[3]: *** [fnbf.lo] Error 1
make[3]: *** Waiting for unfinished jobs....
mpicc -DHAVE_CONFIG_H -I. -I. -I../../src -I../../include -DGMXLIBDIR=\"/usr/share/gromacs-3.2.1/top\" -I/usr/include/libxml2 -O2 -g -I/usr/include/libxml2 -MT macros.lo -MD -MP -MF .deps/macros.Tpo -c macros.c -o macros.o
make[3]: Leaving directory `/var/tmp/portage/gromacs-3.2.1/work/gromacs-3.2.1/src/gmxlib'
make[2]: *** [all-recursive] Error 1
make[2]: Leaving directory `/var/tmp/portage/gromacs-3.2.1/work/gromacs-3.2.1/src'
make[1]: *** [all] Error 2
make[1]: Leaving directory `/var/tmp/portage/gromacs-3.2.1/work/gromacs-3.2.1/src'
make: *** [all-recursive] Error 1

!!! ERROR: sci-chemistry/gromacs-3.2.1 failed.
!!! Function src_compile, Line 54, Exitcode 2
!!! (no error message)
!!! If you need support, post the topmost build error, NOT this status message.

Can you please provide emerge --info?
Comment 2 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-04-27 09:03:32 UTC
Portage 2.0.51.19 (default-linux/ppc64/2005.0, gcc-3.4.3, glibc-2.3.4.20041102-r
1, 2.6.11-gentoo-r6 ppc64)
=================================================================
System uname: 2.6.11-gentoo-r6 ppc64 POWER5 (gr)
Gentoo Base System version 1.4.16
Python:              dev-lang/python-2.3.4-r1 [2.3.4 (#1, Apr  9 2005, 06:30:42)
]
ccache version 2.3 [enabled]
dev-lang/python:     2.3.4-r1
sys-devel/autoconf:  2.59-r6, 2.13
sys-devel/automake:  1.7.9-r1, 1.8.5-r3, 1.5, 1.4_p6, 1.6.3, 1.9.4
sys-devel/binutils:  2.15.90.0.3-r4
sys-devel/libtool:   1.5.10-r4
virtual/os-headers:  2.6.8.1-r2
ACCEPT_KEYWORDS="ppc64"
AUTOCLEAN="yes"
CFLAGS="-O2 -mcpu=power5 -mtune=power5 -pipe -fomit-frame-pointer"
CHOST="powerpc64-unknown-linux-gnu"
CONFIG_PROTECT="/etc /usr/kde/2/share/config /usr/kde/3/share/config /usr/lib/X1
1/xkb /usr/share/config /var/qmail/control"
CONFIG_PROTECT_MASK="/etc/gconf /etc/terminfo /etc/env.d"
CXXFLAGS="-O2 -mcpu=power5 -mtune=power5 -pipe -fomit-frame-pointer"
DISTDIR="/usr/portage/distfiles"
FEATURES="autoaddcvs autoconfig ccache distlocks sandbox sfperms strict"
GENTOO_MIRRORS="http://mirror.datapipe.net/gentoo/"
MAKEOPTS="-j6"
PKGDIR="/usr/portage/packages"
PORTAGE_TMPDIR="/var/tmp"
PORTDIR="/usr/portage"
PORTDIR_OVERLAY="/usr/local/portage"
SYNC="rsync://rsync.gentoo.org/gentoo-portage"
USE="X berkdb bitmap-fonts ccache cdr cups fortran gdbm gif gpm gtk ibm java jpe
g ncurses nls nptl opengl pam perl png ppc64 python readline server slang ssl tc
pd tiff truetype truetype-fonts type1-fonts unicode xml2 zlib"
Unset:  ASFLAGS, CBUILD, CTARGET, LANG, LC_ALL, LDFLAGS, LINGUAS
Comment 3 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-04-27 09:07:56 UTC
Works fine here on 3 different systems
Comment 4 Markus Rothe (RETIRED) gentoo-dev 2005-04-29 12:37:33 UTC
This just does not compile on my G5. if I run configure with --disable-ppc-altivec it builds fine. I'm clueless :-/
Comment 5 Brent Baude (RETIRED) gentoo-dev 2005-04-29 17:19:48 UTC
If it makes you feel any better, I'm seeing a similar problem.  The machines that Omkhar has been building on do not have altivec based procs.  It build fine with or without altivec on my OpenPower boxes.

I was testing a patch for the ebuild (will also attach) that enables the use of the altivec USE flag and decided to test on a JS20 blade, which does have altivec.  And guess, what? same failure.  I will check the usual candidates like make.profiles and see what comes of it.  As for now, beer time ;)

Comment 6 Brent Baude (RETIRED) gentoo-dev 2005-04-29 17:20:33 UTC
Created attachment 57631 [details, diff]
enables USE for altivec

This allows you to turn off altivec (since the config assumes +altivec)
Comment 7 Brent Baude (RETIRED) gentoo-dev 2005-04-29 17:31:46 UTC
Ok last thing for tonight.  With the patch applied, I did a :

USE="-altivec" emerge  gromacs

and that worked.

My make profile is as follows:

/etc/make.profile -> ../usr/portage/profiles/default-linux/ppc64/2005.0

as with the non-altivec systems.

CFLAGS="-O2 -pipe -mtune=970 -mcpu=970"
USE="unicode pam berkdb bitmap-fonts gif jpeg nls ncurses perl png ppc64 python readline ssl tcpd truetype truetype-fonts type1-fonts zlib altivec fortran mysql"

So perhaps some altivec voodoo foo is involved?
Comment 8 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-04-30 15:25:21 UTC
Created attachment 57692 [details, diff]
gromacs-altivec.patch

Same thing as ranger updated the bug with - just uses "use_with" per proper
ebuild joo-joo
Comment 9 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-04-30 15:39:22 UTC
Created attachment 57694 [details, diff]
gromacs-altivec.patch

Sorry I'm just removing some digest g0rp
Comment 10 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-05-01 10:55:50 UTC
Created attachment 57757 [details, diff]
gromacs-cleanup.patch

OK there are some other things that should be cleaned up a little - here is a
patch for a better one.
Comment 11 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-05-02 09:00:36 UTC
-altivec allows this to compile okey dokey 

Investigating why +altivec fails..
Comment 12 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-08-04 12:07:00 UTC
new gromacs-3.2.1-r1 in portage should work with ppc64 altivec
Comment 13 Jeffrey Gardner (RETIRED) gentoo-dev 2005-08-04 13:18:30 UTC
Well it breaks on amd64...

[ebuild     U ] sci-chemistry/gromacs-3.2.1-r1 [3.2.1] (-altivec) +mpi +xml2 0 kB 


 * Applying gromacs-ppc64-altivec.patch ...

 * Failed Patch: gromacs-ppc64-altivec.patch !
 *  ( /usr/portage/sci-chemistry/gromacs/files/gromacs-ppc64-altivec.patch )
 * 
 * Include in your bugreport the contents of:
 * 
 *   /var/tmp/portage/gromacs-3.2.1-r1/temp/gromacs-ppc64-altivec.patch-12120.out


!!! ERROR: sci-chemistry/gromacs-3.2.1-r1 failed.
!!! Function epatch, Line 359, Exitcode 0
!!! Failed Patch: gromacs-ppc64-altivec.patch!
!!! If you need support, post the topmost build error, NOT this status message.



***** gromacs-ppc64-altivec.patch *****

=======================================

PATCH COMMAND:  patch -p0 -g0 --no-backup-if-mismatch <
/usr/portage/sci-chemistry/gromacs/files/gromacs-ppc64-altivec.patch

=======================================
patching file gromacs-3.2.1/include/ppc_altivec.h
Hunk #1 FAILED at 33.
1 out of 1 hunk FAILED -- saving rejects to file
gromacs-3.2.1/include/ppc_altivec.h.rej
=======================================

PATCH COMMAND:  patch -p1 -g0 --no-backup-if-mismatch <
/usr/portage/sci-chemistry/gromacs/files/gromacs-ppc64-altivec.patch

=======================================
can't find file to patch at input line 4
Perhaps you used the wrong -p or --strip option?
The text leading up to this was:
--------------------------
|diff -Naur gromacs-3.2.1/include/ppc_altivec.h
gromacs-3.2.1-new/include/ppc_altivec.h
|--- gromacs-3.2.1/include/ppc_altivec.h	2003-11-18 02:41:58.000000000 -0600
|+++ gromacs-3.2.1-new/include/ppc_altivec.h	2005-08-04 13:42:05.000000000 -0500
--------------------------
No file to patch.  Skipping patch.
1 out of 1 hunk ignored
=======================================

PATCH COMMAND:  patch -p2 -g0 --no-backup-if-mismatch <
/usr/portage/sci-chemistry/gromacs/files/gromacs-ppc64-altivec.patch

=======================================
can't find file to patch at input line 4
Perhaps you used the wrong -p or --strip option?
The text leading up to this was:
--------------------------
|diff -Naur gromacs-3.2.1/include/ppc_altivec.h
gromacs-3.2.1-new/include/ppc_altivec.h
|--- gromacs-3.2.1/include/ppc_altivec.h	2003-11-18 02:41:58.000000000 -0600
|+++ gromacs-3.2.1-new/include/ppc_altivec.h	2005-08-04 13:42:05.000000000 -0500
--------------------------
No file to patch.  Skipping patch.
1 out of 1 hunk ignored
=======================================

PATCH COMMAND:  patch -p3 -g0 --no-backup-if-mismatch <
/usr/portage/sci-chemistry/gromacs/files/gromacs-ppc64-altivec.patch

=======================================
missing header for unified diff at line 4 of patch
can't find file to patch at input line 4
Perhaps you used the wrong -p or --strip option?
The text leading up to this was:
--------------------------
|diff -Naur gromacs-3.2.1/include/ppc_altivec.h
gromacs-3.2.1-new/include/ppc_altivec.h
|--- gromacs-3.2.1/include/ppc_altivec.h	2003-11-18 02:41:58.000000000 -0600
|+++ gromacs-3.2.1-new/include/ppc_altivec.h	2005-08-04 13:42:05.000000000 -0500
--------------------------
No file to patch.  Skipping patch.
1 out of 1 hunk ignored
=======================================

PATCH COMMAND:  patch -p4 -g0 --no-backup-if-mismatch <
/usr/portage/sci-chemistry/gromacs/files/gromacs-ppc64-altivec.patch

=======================================
missing header for unified diff at line 4 of patch
can't find file to patch at input line 4
Perhaps you used the wrong -p or --strip option?
The text leading up to this was:
--------------------------
|diff -Naur gromacs-3.2.1/include/ppc_altivec.h
gromacs-3.2.1-new/include/ppc_altivec.h
|--- gromacs-3.2.1/include/ppc_altivec.h	2003-11-18 02:41:58.000000000 -0600
|+++ gromacs-3.2.1-new/include/ppc_altivec.h	2005-08-04 13:42:05.000000000 -0500
--------------------------
No file to patch.  Skipping patch.
1 out of 1 hunk ignored
Comment 14 Jeffrey Gardner (RETIRED) gentoo-dev 2005-08-04 13:21:01 UTC
$ emerge info
Portage 2.0.51.22-r2 (default-linux/amd64/2005.0, gcc-3.4.3, glibc-2.3.5-r1,
2.6.12-gentoo-r6 x86_64)
=================================================================
System uname: 2.6.12-gentoo-r6 x86_64 AMD Opteron(tm) Processor 246
Gentoo Base System version 1.6.13
dev-lang/python:     2.3.5
sys-apps/sandbox:    1.2.11
sys-devel/autoconf:  2.13, 2.59-r6
sys-devel/automake:  1.4_p6, 1.5, 1.6.3, 1.7.9-r1, 1.8.5-r3, 1.9.5
sys-devel/binutils:  2.15.92.0.2-r10
sys-devel/libtool:   1.5.18-r1
virtual/os-headers:  2.6.11-r2
ACCEPT_KEYWORDS="amd64"
AUTOCLEAN="yes"
CBUILD="x86_64-pc-linux-gnu"
CFLAGS="-march=opteron -mtune=opteron -Os -pipe"
CHOST="x86_64-pc-linux-gnu"
CONFIG_PROTECT="/etc /usr/kde/2/share/config /usr/kde/3.4/env
/usr/kde/3.4/share/config /usr/kde/3.4/shutdown /usr/kde/3/share/config
/usr/lib/X11/xkb /usr/lib64/mozilldefaults/pref /usr/share/config
/var/qmail/control"
CONFIG_PROTECT_MASK="/etc/gconf /etc/splash /etc/terminfo /etc/env.d"
CXXFLAGS="-march=opteron -mtune=opteron -Os -pipe"
DISTDIR="/usr/portage/distfiles"
FEATURES="autoconfig distlocks sandbox sfperms strict"
GENTOO_MIRRORS="http://gentoo.ccccom.com http://mirrors.tds.net/gentoo
ftp://gentoo.ccccom.com http://gentoo.osuosl.org
http://www.ibiblio.org/pub/Linux/distributions/gtoo"
MAKEOPTS="-j3"
PKGDIR="/usr/portage/packages"
PORTAGE_TMPDIR="/var/tmp"
PORTDIR="/usr/portage"
PORTDIR_OVERLAY="/usr/local/portage"
SYNC="rsync://rsync.namerica.gentoo.org/gentoo-portage"
USE="amd64 3xnowex X a52 aac alsa apache2 avi berkdb bitmap-fonts browserplugin
cdr crypt cups curl directfb dvd dvdr dvdread encode esd extensions f77 fbcon
ffmpeg fftfirefox flac foomaticdb fortran gb gd gdbm gif gnome gnutls gpm gtk
gtk2 gtkhtml hal imagemagick imlib inkjar ithreads java jce jpeg jpg libgda lirc
live lzw lzw-tiff m maildir mjpeg motif mozcalendar mozilla moznocompose
moznoirc moznomail mozsvg mp3 mpeg mpi mpqc mysql ncurses netcdf network nls
no_wxgtk1 nptl nvidia ogg oggvorbis ongl pam pdflib perl plotutils plugin png
pnp ppds python quicktime readline rtc sasl sdl spell ssl svg tcltk tcpd threads
tiff toolbar truetype truetype-fonts type1-fon usb userlocales v4l vorbis wmf
xinetd xml xml2 xpm xprint xv xvid zlib userland_GNU kernel_linux elibc_glibc"
Unset:  ASFLAGS, CTARGET, LANG, LC_ALL, LDFLAGS, LINGUAS
Comment 15 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-08-04 18:05:52 UTC
Thats really wierd, the patch works fine even on x86 systems over here
Comment 16 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-08-04 18:29:39 UTC
ranger confirms an issue on his system, looks like possible corruption in the 
patch
Comment 17 Markus Rothe (RETIRED) gentoo-dev 2005-08-05 05:15:27 UTC
omkhar: you have this line in the patch:

 static char *SRCID_ppc_altivec_h = "$Id: gromacs-ppc64-altivec.patch,v 1.1
2005/08/04 19:05:26 omkhar Exp $";

every time you commit it to cvs, cvs will change $Id. You have to add this file
like this: cvs add -ko gromacs-ppc64-altivec.patch

I have had exactly the same problem commiting a phpsysinfo patch ;-)
Comment 18 t35t0r 2005-08-05 08:49:41 UTC
I'm getting the same altivec patch error, I added myself to cc keep me posted.
Comment 19 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-08-05 08:58:06 UTC
corsair was right, I've checked the patch back in with -ko, also changed up 
the ebuild so the patch will only apply when ppc64 && altivec.

Now we wait for the patch to mill out into portage
Comment 20 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-08-06 07:35:27 UTC
Everything looks proper in portage - test away
Comment 21 Omkhar Arasaratnam (RETIRED) gentoo-dev 2005-08-08 06:57:15 UTC
OK everyone seems happy for now
Comment 22 Markus Rothe (RETIRED) gentoo-dev 2006-05-07 12:44:20 UTC
stable. closing