Characterization, phase solubility and molecular modeling of α-cyclodextrin/pyrimethamine inclusion complex

Quantum chemical study and isothermal titration calorimetry of β-cyclodextrin complexes with mianserin in aqueous solution

“…17 This method has been applied in several earlier studies on inclusion complexes with cyclodextrins. [18][19][20][21][22][23][24][25][26][27] It allows to handle hydrogen bonds 28 and, as shown in ref. [18][19][20][21], predicts structural properties of such systems which are coherent with experimental results.…”

The effect of mechanical grinding on the formation, crystalline changes and dissolution behaviour of the inclusion complex of telmisartan and β-cyclodextrins

“…Among them, MIC_1:3_30 showed to be more stable thermodynamically than others formulations, once that its endothermic event appeared at a highest temperature of 189 °C (Aigner et al, 2012;Araujo et al, 2009;Giordano et al, 2001;He et al, 2013).…”

“…These formulations were further investigated by FTIR and XRPD in order to confirm the formation of MIC (Aigner et al, 2012;Araujo et al, 2009;Giordano et al, 2001;He et al, 2013).…”

Inclusion complexes of ortho-anisidine and β-cyclodextrin: A quantum mechanical calculation

“…Recently, the new semi-empirical method PM6 (parameterized model 6) was introduced [10][11][12][13][14], which is superior to other semi-empirical QM methods in various aspects. As compared to the earlier semi-empirical methods AM1 and PM3, several modifications have been made to the neglect of diatomic differential overlap (NDDO) core-core interaction term and to the parameter optimization method.…”