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. 2015 Jul 2;10(7):e0132311. doi: 10.1371/journal.pone.0132311

Table 3. Interaction energies measured between Fel d 1 monomers during molecular dynamics simulations under different force fields (kJ/mol).

AMBER CHARMM GROMOS
With Ca2+ ions -718.07±65.49 -599.44±69.71 -570.57±67.84
Without Ca2+ions -728.87±69.52 -772.41±67.47 -617.71±87.07