mopac binary package in Ubuntu Noble s390x

 MOPAC is a general-purpose semiempirical molecular orbital package for the
 study of solid state and molecular structures and reactions.
 .
 The semiempirical Hamiltonians MNDO, AM1, PM3, PM6, RM1, MNDO-d and PM7 are
 used in the electronic part of the calculation to obtain molecular orbitals,
 the heat of formation and its derivative with respect to molecular geometry.
 .
 Using these results MOPAC calculates the vibrational spectra, thermodynamic
 quantities, isotopic substitution effects and force constants for molecules,
 radicals, ions, and polymers. For studying chemical reactions, a transition
 state location routine and two transition state optimizing routines are
 available. For users to get the most out of the program, they must understand
 how the program works, how to enter data, how to interpret the results, and
 what to do when things go wrong.

Publishing history

Date Status Target Pocket Component Section Priority Phased updates Version
  Deleted Ubuntu Noble s390x proposed universe science Optional 22.1.1-2
  • Removal requested .
  • Deleted by Steve Langasek

    Moved to oracular-proposed

  • Published
  2024-02-15 13:43:59 UTC Superseded Ubuntu Noble s390x proposed universe science Optional 22.1.0-1
  • Removed from disk .
  • Removal requested .
  • Superseded by s390x build of mopac 22.1.1-2 in ubuntu noble PROPOSED
  • Published
  2023-10-23 22:30:24 UTC Published Ubuntu Noble s390x release universe science Optional 22.0.6+dfsg-1
  • Published
  • Copied from ubuntu lunar-proposed s390x in Primary Archive for Ubuntu

Source package