Dear all

I have generated a QSAR model with GFA and PLS on a training set of compounds, now I would like to use these 2 models to predict the activity values (IC50) for a another set of compounds, but I am not sure how to do it

I tried with Calculate Molecular Properties, and I choose the GFA / PLS model, but I got only the statistics on this new set of compounds (Mean, STDev,N, Min, Max), not the IC50

Any help will be really appreciated,

Thank you very much in advance
Cristina Dezi