Your message dated Sun, 01 Oct 2023 01:12:57 +0000 with message-id <e1qml0z-00eowq...@fasolo.debian.org> and subject line Bug#998401: fixed in nwchem 7.2.0-1exp1 has caused the Debian Bug report #998401, regarding nwchem: remove csh requirement to be marked as done.
This means that you claim that the problem has been dealt with. If this is not the case it is now your responsibility to reopen the Bug report if necessary, and/or fix the problem forthwith. (NB: If you are a system administrator and have no idea what this message is talking about, this may indicate a serious mail system misconfiguration somewhere. Please contact ow...@bugs.debian.org immediately.) -- 998401: https://bugs.debian.org/cgi-bin/bugreport.cgi?bug=998401 Debian Bug Tracking System Contact ow...@bugs.debian.org with problems
--- Begin Message ---Package: nwchem Version: |7.0.2-2| Severity: normal Dear Maintainer, NWChem 7.0.0 (and later versions) no longer require csh/tcsh. I have opened a pull request with the necessary changes on the debichem repository at |[1].| Cheers, Edo || |[1] https://salsa.debian.org/debichem-team/nwchem/-/merge_requests/1| ||
--- End Message ---
--- Begin Message ---Source: nwchem Source-Version: 7.2.0-1exp1 Done: Drew Parsons <dpars...@debian.org> We believe that the bug you reported is fixed in the latest version of nwchem, which is due to be installed in the Debian FTP archive. A summary of the changes between this version and the previous one is attached. Thank you for reporting the bug, which will now be closed. If you have further comments please address them to 998...@bugs.debian.org, and the maintainer will reopen the bug report if appropriate. Debian distribution maintenance software pp. Drew Parsons <dpars...@debian.org> (supplier of updated nwchem package) (This message was generated automatically at their request; if you believe that there is a problem with it please contact the archive administrators by mailing ftpmas...@ftp-master.debian.org) -----BEGIN PGP SIGNED MESSAGE----- Hash: SHA256 Format: 1.8 Date: Fri, 29 Sep 2023 11:57:34 +0200 Source: nwchem Architecture: source Version: 7.2.0-1exp1 Distribution: experimental Urgency: medium Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org> Changed-By: Drew Parsons <dpars...@debian.org> Closes: 998401 Changes: nwchem (7.2.0-1exp1) experimental; urgency=medium . * New upstream release - applies debian patch fix_py310_6384013.diff - Build-Depends: bc * add Drew Parsons as uploader * convert debian/copyright to machine-readable format. Still licensed under the Educational Community License, Version 2.0 * maintain local copy of DFT-D3 source at debian/dftd3/dftd3.tgz (GPL licence). The nwchem build normally downloads dftd3 at build time, but internet access is forbidden at build-time by Debian policy, hence a local copy is needed. Used by NWPW (XC) i.e. src/nwpw/nwpwlib/nwpwxc Downloaded from https://www.chemiebn.uni-bonn.de/pctc/mulliken-center/software/dft-d3/ DFT-D3 status documented in debian/README.source. * lintian fixes - drop -X-Python-Version and Build-Depends: autotools-dev from debian/control - use dpkg-architecture conditionally (?=) in debian/rules - fix GPL-3 entry in debian/copyright - update lintian overrides (nwchem-data) * drop Build-Depends: csh and convert debian/testsuite to bash. Some scripts in the source tarball still use csh, but not the ones used by the debian build (e.g. QA/runtests.mpi.unix) Thanks Edoardo Apra. Closes: #998401. * debian patch test_ch5n_nbo_Issue864.patch patches the ch5n_nbo test with DIRECT to enable the SCF energy to pass tolerance (otherwise the energy differs by 1e-5 Hartree). See upstream Issue #864. Checksums-Sha1: f3eb02114e7928fc3022511f06759cb72b56bb45 2600 nwchem_7.2.0-1exp1.dsc 85c9cd85a8e687cc02014c6f9f9060cdb404910b 210819912 nwchem_7.2.0.orig.tar.gz 3c2358033a1bba7b47fa520a951a1a25c4d390f4 557936 nwchem_7.2.0-1exp1.debian.tar.xz Checksums-Sha256: fae6e5421a3099575cd2f94fd3699507ec0533ba3fbb2e58e75eaeca38cf885c 2600 nwchem_7.2.0-1exp1.dsc 321c57a1994fd12546cb0d5f86c3bd8bd305d4420a9d7d416f3d765c428cdae4 210819912 nwchem_7.2.0.orig.tar.gz 9f55c7bf4a5b979ae93d7ac6ea45374ceebb95c0e62341921f21a7492b877997 557936 nwchem_7.2.0-1exp1.debian.tar.xz Files: 9601dae1ea635959e3316d739b1ed67d 2600 science optional nwchem_7.2.0-1exp1.dsc c9421766ebd5e5eab2e50a91164ed693 210819912 science optional nwchem_7.2.0.orig.tar.gz f0aa3e7170ac488fbbf33dc57cad3510 557936 science optional nwchem_7.2.0-1exp1.debian.tar.xz -----BEGIN PGP SIGNATURE----- iQIzBAEBCAAdFiEEI8mpPlhYGekSbQo2Vz7x5L1aAfoFAmUYtsYACgkQVz7x5L1a AfovjRAAvB79QU/QatBGOubCcIpjsgR7qVd3smkixIFIgC8RdgbjB6D9gzxk7Y5z 3s+93pp0P1Z6iCB9BZY5bLizhPXJBTDyFZmHhVBn0+/zI5elSrwL2mW2d0qSPeSZ +YVfg1Bxjyz/ieoJkHH4Ap0s+lPDzTu5rg7mJw6BjqA7WfemYYgJnjPDOTHB7X4L 52lIIEexE4xpTIP0U7RO4dZ9aHPBzsVppVaYMo63LCemEq3SPenytcHuq2/8xqhU Fkz1spG/es/Jblo8tV6/8bhPDgNTAqsCQklyq15iSfeuanzvm/1B4+R9jmLThJDu 8p+LaVvAlWUq6mtvgH6ifNBrrLteUzuoq42nw0oWUJQ1hRhlfz9SJhnKwkrr44H/ FIbX9bVqMJ3TUCQXgAB01la4Y07jAbJr0XqRfWfD06jNEmOfquM0dAZ785MY+0S+ zJ93BdNKGG2JctVxh7AT5eSrERXRTERnt7dfxC5jQxGyu9/GSjWUN7PhhXiA436r aQNc6ufG8BTUYqIzg9N2aWpnM1kfHenRUZYwR/YTt8hKM+vXyQuRmqj1eBBIwe/L 1kRLej/hNLNAbbBiaZTKCeLBIbywBd9jbBYytaPUi3lmmLgSb/aTck1SxvJ1esLa 29Go5kjVGwgW9GyR7M5nPYic/oKUSrvB5++VCHftfVllmQJQ7Aw= =IGHT -----END PGP SIGNATURE-----
--- End Message ---
