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Questions related from Huy Nguyen
Hi, I'm working on my final project about QSAR and docking. I used MOE 2015 to create a database with 128 entries and calculate 206 2D-QSAR descriptors. Now I want to select about 6-8 descriptors...
04 April 2019 8,683 5 View
- My QSAR model has correlation coefficient r2 = 0,90 and RMSE = 0,30 (training set: 102 entries), - I did cross validation (Leave-One-Out) and it's also good result: xr2 = 0,86 and xRMSE = 0,36....
04 April 2019 5,497 3 View
