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mopac7-bin

Semi-empirical Quantum Chemistry Library (binaries)

Variants:
MOPAC provides routines to solve the electronic structure of molecules on a semi-empirical level. Available methods include MNDO, MINDO/3, AM1 and PM3.

This package contains the MOPAC7 binaries.

Homepage:
Package version:1.15-5
Architecture:amd64
Distribution:Debian
Filename:mopac7-bin_1.15-5_amd64.deb

/usr/share/man/man1/run_mopac7.1.gz

RUN_MOPAC(1)                   MOPAC7                   RUN_MOPAC(1)



NAME
       run_mopac7 - invoke mopac7 program


SYNOPSIS
       run_mopac7 name


DESCRIPTION
       MOPAC  provides routines to solve the electronic structure of
       molecules  on  a  semi-empirical  level.  Available   methods
       include MNDO, MINDO/3, AM1 and PM3.

       run_mopac7  will read input from name.dat an
more»

/usr/share/doc/mopac7-bin/changelog.Debian.gz

mopac7 (1.15-5) unstable; urgency=low

  * debian/compat: Bumped dh compat level to 7.
  * debian/control (Standards-Version): Bumped to 3.9.3.
    (Build-Depends): Increased dh version. Dropped cdbs and dpatch.
    (Vcs-Browser): Fixed.
  * debian/rules: Debhelper 7 rewrite.
  * debian/upstream: Added.
  * debian/patches/04_limit_atoms.dpatch: Renamed to
    debian/patches/limit_atoms.patch.
  * 
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/usr/share/doc/mopac7-bin/changelog.gz

2006-04-24 14:50  thassine

	* Makefile.am, configure, configure.ac, tests/.cvsignore,
	  tests/Makefile.am, tests/Makefile.in: configuration changes for
	  v1.11 (final?)

2006-04-24 14:45  thassine

	* .cvsignore, Makefile.in, fortran/.cvsignore, fortran/Makefile.am,
	  fortran/c_src_bak/.cvsignore, fortran/c_src_bak/Makefile.am,
	  src/.cvsignore, src/Makefile.in: some improvements added ; this
more»

/usr/share/doc/mopac7-bin/copyright

This package was debianized by Michael Banck <mbanck@debian.org> on
Fri,  1 Jul 2005 21:38:37 +0200.
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