APBS 0.2.2 (2002-08)ΒΆ

  • There were several other changes along the way... I lost track.
  • Changed coordinate indexing in some energy calculations
  • Updated documentation to reflect recent changes on Blue Horizon
  • Improved speed of problem setup BUT NOW RESTRICT use of input coefficient maps (see documentation)
  • Updated documentation, placing particular emphasis on use of Intel compilers and vendor BLAS on Intel Linux systems
  • Fixed bug for nonpolar force evaluation in Vpmg_dbnpForce
  • Removed MG test scripts; use bin/*.c for templates/testing
  • Made main driver code completely memory-leak free (i.e., if you wanted to wrap it and call it repeatedly – Thanks to Robert Konecny)
  • Fixed main driver code for compatibility with SGI compilers (Thanks to Fabrice Leclerc)
  • Made focused evaluation of forces more sensible.
  • Added ‘print force’ statement
  • Fixed bug in OpenDX input/output (OpenDX documentation is lousy!)