Tripeptide,ff94 RMSD [kJ/mol],CP3-q RMSD [kJ/mol],CP3 RMSD [kJ/mol],AMOEBA RMSD [kJ/mol],M2P2 RMSD [kJ/mol]
ALA,34.40,23.30,14.77,8.54,2.87
ARG,27.93,20.99,12.65,9.25,3.39
ASH,37.01,25.80,15.07,8.95,3.36
ASN,37.16,25.25,14.42,9.15,3.31
ASP,37.39,24.18,13.10,7.64,3.79
CYD,37.33,24.07,12.44,8.21,4.81
CYS,37.40,26.81,17.07,7.30,3.87
CYX,28.62,24.21,8.47,6.80,9.04
GLH,33.93,23.37,13.43,7.01,3.00
GLN,31.48,22.33,13.57,6.99,2.96
GLU,35.02,23.77,13.03,9.05,3.65
GLY,32.11,21.48,14.07,9.37,2.81
HID,34.28,23.48,11.91,7.18,2.62
HIE,34.30,24.77,14.74,7.69,3.91
HIS,32.68,28.90,18.29,7.14,4.76
ILE,35.02,23.38,12.84,7.58,3.45
LEU,36.18,25.40,13.18,7.50,3.33
LYD,32.31,22.87,12.86,7.20,3.29
LYS,31.83,24.17,14.59,7.21,3.42
MET,33.55,23.34,12.99,7.79,3.43
PHE,30.76,21.93,12.70,6.90,3.78
PRO,33.63,22.54,12.53,5.38,3.23
SER,34.82,22.62,13.91,8.66,2.99
THR,32.79,23.89,13.48,8.63,3.00
TRP,31.60,21.28,11.32,7.59,3.42
TYR,34.47,23.10,12.85,7.18,3.25
VAL,34.97,23.26,14.18,7.99,3.41
Average,33.81,23.83,13.50,7.77,3.64