Research Article

Combined Ligand/Structure-Based Virtual Screening and Molecular Dynamics Simulations of Steroidal Androgen Receptor Antagonists

Table 3

The correlation coefficients () of the selected descriptors in the model.

IC5GATS5eDISPpHATS3u

IC51
GATS5e0.071
DISPp0.250.361
HATS3u−0.6250.19−0.151