Potency Prediction of β-Secretase (BACE-1) Inhibitors Using Density Functional Methods. - Katarina Roos; Jenny Viklund; Johan Meuller; Karin Kaspersson; Mats Svensson (J. Chem. Inf. Model., 2014)

Predicting the relative binding affinity of mineralocorticoid receptor antagonists by density functional methods. - Katarina Roos; Anders Hogner; Derek Ogg; Martin J. Packer; Eva Hansson; Kenneth L. Granberg; Emma Evertsson; Anneli Nordqvist (J. Comput. Aided Mol. Des., 2015)