Your message dated Tue, 21 Feb 2012 01:34:14 +0100 with message-id <[email protected]> and subject line Re: [Debichem-devel] Bug#649381: mpqc: Please enable mp2r12 has caused the Debian Bug report #649381, regarding mpqc: Please enable mp2r12 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 [email protected] immediately.) -- 649381: http://bugs.debian.org/cgi-bin/bugreport.cgi?bug=649381 Debian Bug Tracking System Contact [email protected] with problems
--- Begin Message ---Package: mpqc Version: 2.3.1-10 Severity: wishlist Running mpqc on /usr/share/doc/mpqc/examples/mp2r12ah2o.in results in an error: nighthawk/tmp$ mpqc mp2r12ah2o.in Reading file /usr/share/mpqc/atominfo.kv. MPQC: Massively Parallel Quantum Chemistry Version 2.3.1 Machine: i486-pc-linux-gnu User: mbanck@nighthawk Start Time: Sun Nov 20 15:24:43 2011 Using ProcMessageGrp for message passing (number of nodes = 1). Using PthreadThreadGrp for threading (number of threads = 1). Using ProcMemoryGrp for distributed shared memory. Total number of processors = 1 ClassDesc::load_class looking for "./classes" ClassDesc::load_class("IntegralCints"): load failed Either "IntegralCints" is an invalid class name or the code for "IntegralCints" was not linked into the executable. Segmentation fault This is because libSCcints and (at least) libSCmbptr12 are not shipped in libsc7. -- System Information: Debian Release: 6.0.2 APT prefers stable APT policy: (500, 'stable') Architecture: i386 (i686) Kernel: Linux 2.6.32-5-686 (SMP w/1 CPU core) Locale: LANG=de_DE.UTF-8, LC_CTYPE=de_DE.UTF-8 (charmap=UTF-8) Shell: /bin/sh linked to /bin/dash Versions of packages mpqc depends on: ii libatlas3gf-base [liblapack.s 3.8.3-27 Automatically Tuned Linear Algebra ii libblas3gf [libblas.so.3gf] 1.2-8 Basic Linear Algebra Reference imp ii libc6 2.11.2-10 Embedded GNU C Library: Shared lib ii libgcc1 1:4.4.5-8 GCC support library ii libgfortran3 4.4.5-8 Runtime library for GNU Fortran ap ii liblapack3gf [liblapack.so.3g 3.2.1-8 library of linear algebra routines ii libsc-data 2.3.1-6 The Scientific Computing Toolkit ( ii libsc7 2.3.1-6 The Scientific Computing Toolkit ii libstdc++6 4.6.0-2 The GNU Standard C++ Library v3 mpqc recommends no packages. Versions of packages mpqc suggests: pn mpqc-support <none> (no description available) -- no debconf information
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--- Begin Message ---Version: 2.3.1-12 On Sun, Nov 20, 2011 at 03:26:08PM +0100, Michael Banck wrote: > Running mpqc on /usr/share/doc/mpqc/examples/mp2r12ah2o.in results in an > error: [...] > ClassDesc::load_class("IntegralCints"): load failed > Either "IntegralCints" is an invalid class name or the code > for "IntegralCints" was not linked into the executable. > Segmentation fault > > This is because libSCcints and (at least) libSCmbptr12 are not shipped > in libsc7. This is now working with mpqc_2.3.1-12. Michael
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