Avogadro with GAMESS-US: Optimization

Avogadro with GAMESS-US: Optimization

GAMESS-US TUTORIAL: OPTIMIZATION OF ACETAMINOPHEN 1) MAKE INPUT IN AVOGADRO 2) RUN GAMESS THE NASTY WAY : rungms.bat input.inp 13-64.pgi.linux.blas 4 0 output.log 3) RUN GAMESS THE NICE WAY: python run_gamess_job.py input.inp processors 4) ANALYZE Discover A Lot More