1. 15 Oct, 2014 1 commit
  2. 13 Oct, 2014 1 commit
  3. 06 Oct, 2014 4 commits
  4. 03 Oct, 2014 1 commit
  5. 01 Oct, 2014 6 commits
  6. 23 Sep, 2014 1 commit
  7. 18 Sep, 2014 1 commit
  8. 17 Sep, 2014 2 commits
  9. 08 Sep, 2014 1 commit
  10. 02 Sep, 2014 1 commit
  11. 29 Aug, 2014 1 commit
  12. 26 Aug, 2014 2 commits
  13. 22 Aug, 2014 1 commit
  14. 20 Aug, 2014 1 commit
  15. 16 Aug, 2014 1 commit
  16. 10 Aug, 2014 1 commit
    • Jason Swails's avatar
      Redo the way CHARMM PSF files are parsed. This should be much more robust in · 4b9221e3
      Jason Swails authored
      terms of supporting PSF files that don't really conform to the "standard" way
      that CHARMM prints them.
      
      The downside is that it relies on ! comment tags which I think are comments for
      CHARMM.  However, the use of !NATOM and !NBOND and other tags seem to be _much_
      more conserved than the general format of the PSF file across different dialects
      of PSFs.  So the current approach should be more flexible.
      4b9221e3
  17. 09 Aug, 2014 1 commit
  18. 07 Aug, 2014 1 commit
  19. 01 Aug, 2014 1 commit
  20. 23 Jul, 2014 1 commit
  21. 21 Jul, 2014 4 commits
  22. 18 Jul, 2014 4 commits
  23. 17 Jul, 2014 2 commits