TABLE 3.

Interaction energy of the cellobiose with water during the equilibrium molecular dynamics simulations with or without cellodextrin

	Cel7A	Cel7B	Cel6A	Cel6B
	kcal/mol	kcal/mol	kcal/mol	kcal/mol
With	−50.5 ± 10.1	−59.7 ± 14.9	−25.4 ± 7.8	−57.4 ± 13.7
Without	−45.2 ± 11.1	−67.8 ± 9.6	−26.1 ± 5.8	−54.2 ± 12.1