Experimental design based 3-D QSAR analysis of steroid-protein interactions: application to human CBG complexes.
An experimental design based 3-D QSAR analysis using a combination of principal component and PLS analysis is presented and applied to human corticosteroid-binding globulin complexes. The predictive capability of the created model is good. The technique can also be used as guidance when selecting new compounds to be investigated.
Norinder
U
U
Astra Research Centre Södertälje, Sweden.
D001665:Binding Sites; D003198:Computer Simulation; D015195:Drug Design; D006801:Humans; D013256:Steroids; D013329:Structure-Activity Relationship; D014156:Transcortin / Q000737:chemistry*
D013256:Steroids; D014156:Transcortin