tagged with computational-chemistry
Displaying 1-2 of 2 total results

franciscoadasme

franciscoadasme/chem.cr

Library for dealing with computational chemistry files

  • 23
  • 1
  • 74
  • 3
  • 1
  • 28 days ago
franciscoadasme

franciscoadasme/psique

PSIQUE is a geometry-based secondary structure assignment method based on DFT calculations

  • 0
  • 0
  • 0
  • 0
  • 1
  • about 1 year ago