The choice of atomic charges calculation scheme in 3D-QSAR modelling of GSK-3β inhibition by paullones.
Osolodkin, D I
The choice of atomic charges calculation scheme in 3D-QSAR modelling of GSK-3β inhibition by paullones. [electronic resource] - Doklady. Biochemistry and biophysics - 274-8 p. digital
Publication Type: Journal Article; Research Support, Non-U.S. Gov't
1608-3091
10.1134/S1607672910050145 doi
Benzazepines--chemistry
Enzyme Inhibitors--chemistry
Glycogen Synthase Kinase 3--antagonists & inhibitors
Glycogen Synthase Kinase 3 beta
Models, Chemical
Quantitative Structure-Activity Relationship
The choice of atomic charges calculation scheme in 3D-QSAR modelling of GSK-3β inhibition by paullones. [electronic resource] - Doklady. Biochemistry and biophysics - 274-8 p. digital
Publication Type: Journal Article; Research Support, Non-U.S. Gov't
1608-3091
10.1134/S1607672910050145 doi
Benzazepines--chemistry
Enzyme Inhibitors--chemistry
Glycogen Synthase Kinase 3--antagonists & inhibitors
Glycogen Synthase Kinase 3 beta
Models, Chemical
Quantitative Structure-Activity Relationship