%0 Generic %A Bongers, Brandon J. %A Sijben, Hubert J. %A Hartog, Peter %A Tarnovskiy, Andrey %A Heitman, Laura %A IJzerman, Adriaan P. %A van Westen, Gerard %D 2022 %T Proteochemometric modeling identifies chemically diverse norepinephrine transporter inhibitors - Protocol Files %U https://data.4tu.nl/articles/dataset/Proteochemometric_modeling_identifies_chemically_diverse_norepinephrine_transporter_inhibitors_-_Protocol_Files/19618068/1 %R 10.4121/19618068.v1 %K machine Learning Predictions %K clustering algorithms %K Experimental Validation Studies %X
This repository contains the Pipeline Pilot protocols and aggregated ChEMBL dataset, as described in the manuscript "Proteochemometric modeling identifies chemically diverse norepinephrine transporter inhibitors"
%I 4TU.ResearchData