some patches do not apply cleanly against Nwchem-6.6.revision27746-src.2015-10-20

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Gets Around
Threads 17
Posts 73
12:48:41 AM PDT - Fri, Jul 22nd 2016
Hi,

do patches need to be applied in a specific order?
I'm running the following:

patches="Tddft_mxvec20.patch.gz Tools_lib64.patch.gz Config_libs66.patch.gz Cosmo_meminit.patch.gz Sym_abelian.patch.gz Xccvs98.patch.gz Dplot_tolrho.patch.gz Driver_smalleig.patch.gz Ga_argv.patch.gz Raman_displ.patch.gz Ga_defs.patch.gz Zgesvd.patch.gz Cosmo_dftprint.patch.gz Txs_gcc6.patch.gz Gcc6_optfix.patch.gz"
for patch in $patches;
do
    if ! test -f $patch;
    then
        wget -q http://www.nwchem-sw.org/download.php?f=$patch -O $patch
    fi
done
if ! test -f Nwchem-6.6.revision27746-src.2015-10-20.tar.gz;
then
    wget -q http://www.nwchem-sw.org/download.php?f=Nwchem-6.6.revision27746-src.2015-10-20.tar.gz -O Nwchem-6.6.revision27746-src.2015-10-20.tar.gz
fi
rm -rf nwchem-6.6
tar zxf Nwchem-6.6.revision27746-src.2015-10-20.tar.gz
cd nwchem-6.6
for patch in $patches;
do
    echo $patch
    gunzip -c ../$patch | patch -p0
done


with this output:

Tddft_mxvec20.patch.gz
patching file QA/tests/tddft_h2o_mxvc20/tddft_h2o_mxvc20.nw
patching file QA/tests/tddft_h2o_mxvc20/tddft_h2o_mxvc20.out
patching file QA/tests/tddft_h2o_uhf_mxvc20/tddft_h2o_uhf_mxvc20.nw
patching file QA/tests/tddft_h2o_uhf_mxvc20/tddft_h2o_uhf_mxvc20.out
Tools_lib64.patch.gz
patching file src/config/makefile.h
Config_libs66.patch.gz
patching file src/config/makefile.h
Hunk #1 succeeded at 2258 (offset 1 line).
Hunk #2 succeeded at 2283 (offset 1 line).
Hunk #3 succeeded at 2433 (offset 1 line).
Cosmo_meminit.patch.gz
patching file src/solvation/hnd_cosmo_lib.F
Sym_abelian.patch.gz
patching file src/symmetry/sym_abelian.F
Xccvs98.patch.gz
patching file src/nwdft/xc/xc_cvs98.F
Dplot_tolrho.patch.gz
patching file src/dplot/dplot_input.F
patching file src/dplot/dplot_dump.F
Driver_smalleig.patch.gz
patching file src/driver/opt_drv.F
Hunk #1 succeeded at 1598 (offset -43 lines).
Ga_argv.patch.gz
patching file src/tools/ga-5-4/gaf2c/gaf2c.c
patching file src/tools/ga-5-4/tcgmsg/fapi.c
Raman_displ.patch.gz
patching file src/property/raman_input.F
patching file src/property/task_raman.F
patching file src/property/raman.F
Ga_defs.patch.gz
patching file src/util/util_mpinap.c
patching file src/util/util_getppn.c
Zgesvd.patch.gz
patching file src/64to32blas/xgesvd.F
patching file src/64to32blas/GNUmakefile
patching file src/config/data.64_to_32
Cosmo_dftprint.patch.gz
patching file src/nwdft/scf_dft/dft_scf.F
Txs_gcc6.patch.gz
patching file src/NWints/texas/assemblx.f
patching file src/NWints/texas/derivat.f
patching file src/NWints/texas/gencon.f
patching file src/NWints/texas/shells.f
patching file src/NWints/texas/zeroint.f
Gcc6_optfix.patch.gz
patching file src/config/makefile.h
Hunk #1 succeeded at 1565 (offset -29 lines).
Hunk #2 FAILED at 1989.
1 out of 2 hunks FAILED -- saving rejects to file src/config/makefile.h.rej


In the past we had snapshot releases available. They were more convenient to test the current development version of nwchem than applying patches.

Forum Vet
Threads 9
Posts 1570
7:57:31 AM PDT - Fri, Jul 22nd 2016
Thanks for notifying the problem with Gcc6_optfix.patch.gz
The new updated file should apply cleanly.


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