Amber ff10

Post date: Apr 13, 2012 2:46:45 PM

leaprc.ff10

meaning

  • ff99SB for proteins
  • ff99bsc0 and chi.OL3 for nucleic acids
  • Updated ion parameters
  • New atom and residue names

"Even for ff10, which automatically loads ions08.lib, you will need to choose a frcmod file that matches the water model you are using."

frcmod.ionsjc_tip3p

See 2.2.1 Variants of ff10 for ILDN and NMR