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. 2021 May 16;26(10):2956. doi: 10.3390/molecules26102956

Table 5.

Decomposition of the interaction energy for stacking acridine molecules in the complexes of fenamic acids with acridine in kcal/mol.

Eelect EPauli Esteric Eorb Edysp Etotal Eelect
Fenamic acidacridine −10.51 21.97 11.46 −4.34 −18.54 −11.42 −10.51
1 −6.19 12.46 6.27 −2.45 −13.39 −9.57 −6.19
2_stack1 −9.08 18.62 9.54 −3.73 −17.47 −11.65 −9.08
2_stack2 −4.63 9.64 5.01 −1.81 −9.67 −6.47 −4.63
3_stack1 −4.02 8.33 4.31 −1.66 −9.26 −6.61 −4.02
3_stack2 −7.97 16.47 8.5 −3.37 −16.91 −11.77 −7.97