-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1 Format: 1.8 Date: Sun, 08 May 2016 12:23:34 +0200 Source: bagel Binary: bagel bagel-data Architecture: source Version: 0.0~git20160507-1 Distribution: unstable Urgency: medium Maintainer: Debichem Team <debichem-devel@lists.alioth.debian.org> Changed-By: Michael Banck <mbanck@debian.org> Description: bagel - Computational Chemistry Package bagel-data - Computational Chemistry Package (data files) Changes: bagel (0.0~git20160507-1) unstable; urgency=medium . * New upstream development snapshot. New features include: + Extended multistate CASPT2 (XMS-CASPT2) energies and gradients. * debian/patches/skip_mrci.patch: Refreshed. * debian/patches/disable_large_integral_file.patch: Likewise. * debian/patches/add_missing_includes.patch: Updated. * debian/patches/skip_failing_testcases.patch: Updated and added one more test. * debian/patches/install_all_basis_sets.patch: New patch, add previously missing basis set files to Makefile.am. * debian/rules (override_dh_auto_configure): Add --disable-scalapack to configure options. * debian/copyright: Changed base license from LGPL-3 to GPL-3. * debian/control (Description): Added XMS-CASPT2 and FCI to capabilities. Checksums-Sha1: 6b993da7e44e40d54d9f1512c1d9fc56e8f9901f 2189 bagel_0.0~git20160507-1.dsc dc572551d3ce8540aedd3b1a3b2b3e382f0703df 23178617 bagel_0.0~git20160507.orig.tar.gz a339ca3fa930667bced17b54b9955108e358b783 6840 bagel_0.0~git20160507-1.debian.tar.xz Checksums-Sha256: f08bba7638aba922d32ea74c6f5d51fdf9aec840f8661cc0e6a5a2755099859f 2189 bagel_0.0~git20160507-1.dsc 6e9d48a5d49d55d0b3bebcbfbe4e8dd0ff0bb4d8454c9c3195144a5138b03dad 23178617 bagel_0.0~git20160507.orig.tar.gz 041f6739095cb508f10e7349bda5195eb1ba62e3d2f36390a444772a59ed5686 6840 bagel_0.0~git20160507-1.debian.tar.xz Files: 844a65229779d338a7ff948d56369dfe 2189 science optional bagel_0.0~git20160507-1.dsc fac6ddeacd0c87597e18136b11144bb6 23178617 science optional bagel_0.0~git20160507.orig.tar.gz b54416ba853f65baef45dff89d2b9a0d 6840 science optional bagel_0.0~git20160507-1.debian.tar.xz -----BEGIN PGP SIGNATURE----- Version: GnuPG v1 iQIcBAEBAgAGBQJXLxlVAAoJENxoaie0NIGwW7EP/j1hAQ2PL6DuqUTbL21gJuzS tdsphdEwl/P0WeVcIoLoArUEsqUiRqJeZyW90oWcJ0cIOX1k/cEjM5pmPudO+Xtu sN+mCM75gWvOLOJ9gd/lupxklnRdrV465HaSkiS2Pw3xD36+epYWSiBrYfhR4y6z 8mSKMcEu40HyJR+qnesZe0mnlsXlGA7Hzi9QD56Gk+pUQTa7dApaUm4sry0/YuHV lzy14zG93Zp0eoMDkayLQ1UYcMc37GYPhfyHyG0/+JfOGuamx9ksnYe08fCprfXW D3nixqNElZTNpJmcZJbeMITmwIEmpWe6uqGNLCzPKVEqGDlO+MzOa99nvbjBy2pK fe0NQBpqqdpJa8Ky2sGK1D0N1kKppP2oYEbOuzTmlQP+ZBjNYO1v+5tdkt/ykqDl GnXHQG2aSFxrrTRANX3pSPaMZM+zSa9vQq9Dz5olOTTw+STJXQJVnSZ6JTQbWySL KqzO2cTyIr6oNYDm+r8ldmb9kWn3NNk/kSLQgAV1jik3O5tLx9+jQD8WSUcsKmoe aTOhKiu9Z/ksDa2W6fy6/T6zsdVrnGi0dOUU4QvjjTIr+cnJur/O0CEff8vhw2ip 1rdyXrvPTVBLDD1XtsMgWpVIZbF9IUp/W3yK5lbd/+rV7Oc83Gl0rramxDpNMXq/ oKxoOIMhP73DcZcJvN3M =Mj+z -----END PGP SIGNATURE-----