[Debichem-devel] aces3_3.0.6-8_i386.changes ACCEPTED into unstable, unstable

[Debian FTP Masters]

Accepted:

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Hash: SHA1

Format: 1.8
Date: Mon, 13 Oct 2014 00:56:11 +0200
Source: aces3
Binary: aces3 aces3-data
Architecture: source i386 all
Version: 3.0.6-8
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-devel at lists.alioth.debian.org>
Changed-By: Michael Banck <mbanck at debian.org>
Description:
 aces3      - Advanced Concepts in Electronic Structure III
 aces3-data - Advanced Concepts in Electronic Structure III
Closes: 687287
Changes:
 aces3 (3.0.6-8) unstable; urgency=medium
 .
   [ Michael Banck ]
   * debian/patches/testsuite_input.patch: Updated all testsuite input files
     with much less demanding H2O coordinates and VDZ basis sets.
   * debian/patches/testsuite_prepare.patch: Run testsuite with two MPI
     processes.  Otherwise, most tests abort.
   * debian/patches/testsuite_quicktests.patch: New patch, define a new set
     $(QUICKTESTS) of tests which only runs a few tests to check basic
     functionality.  Also create a runscript-quick to run them.
   * debian/patches/testsuite_prepare.patch: Adjusted to no longer modify the
     set of tests in $(TESTS).
   * debian/rules (override_dh_auto_test): Run runscript-quick instead of
     runcript.
   * debian/patches/fix_binary_characters_in_output.patch: New patch, crops the
     sial_program variable at 60 characters, avoiding binary garbage at the end
     which makes the ACESIII output files be recognized as binary files by Unix
     tools (Closes: #687287).
   * debian/aces3.install: Install SIO into /usr/share, not /usr/lib, as they
     are architecture-independent.
   * debian/patches/default_directories.patch: Adjusted for new location of the
     SIO files.
   * debian/control (aces3-data): New package.
   * debian/control (aces3/Depends): Depend on it.
   * debian/aces3-data.install: New file, install the SIO and GENBAS files.
   * debian/aces3.install: No longer install SIO and GENBAS files.
   * debian/docs: Renamed to...
   * debian/aces3-data.docs: ...this.
   * debian/upstream (Name, Registration): New fields.
   * debian/upstream (References): Added Comp. Mol. Sci. review.
   * debian/patches/testsuite_compare.patch: New patch, updates the reference
     test suite results with values taken from ACES II calculations on the new
     testsuite inputs from debian/patches/testsuite_input.patch.  In case no ACES
     II results were available (for the test cases 1.3.2.1, 3.1.4.1, 3.1.4.2,
     3.2.2.1 and 3.2.2.2), values from ACES III on amd64 were taken.
   * debian/aces3.install: Install the SIAL compiler into /usr/bin as well.
   * debian/rules (override_dh_auto_test): Update OMPI_MCA environment variable
     to orte_rsh_agent as the original plm_rsh_agent variable is deprecated.
   * debian/patches/makeflags.patch: Added -fno-aggressive-loop-optimizations to
     FFLAGS.
   * debian/upstream: Moved to debian/upstream/metadata.
 .
   [ Andreas Tille ]
   * debian/upstream: New file.
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 5ddfd3eab807e940d9502c2b73ee5b244c502f3f 15680 aces3_3.0.6-8.debian.tar.xz
 70d8d18ecff3374e80318e63137fc8c5e504c3c9 1015276 aces3_3.0.6-8_i386.deb
 86b65734df2824a6800850fef1dd204658f1b167 5738406 aces3-data_3.0.6-8_all.deb
Checksums-Sha256:
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Files:
 9d7f2421c39ac300b4be5f5630033ae3 1978 science optional aces3_3.0.6-8.dsc
 8ed1c7470bbc958d00e5c17adb4c459b 15680 science optional aces3_3.0.6-8.debian.tar.xz
 4d188c3184ef21e1322e11ac9658faed 1015276 science optional aces3_3.0.6-8_i386.deb
 11021e5624db017f92f50a6785c54e09 5738406 science optional aces3-data_3.0.6-8_all.deb

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