Research Article

Chemical Feature-Based Molecular Modeling of Urotensin-II Receptor Antagonists: Generation of Predictive Pharmacophore Model for Early Drug Discovery

Table 4

Validation of the Hypo 1 using the CatScramble program.

Validation numberTotal costCorrelation

Hypo 1150.9140.902269
Random trial_1163.2540.813374
Random trial_2156.2840.869499
Random trial_3162.4490.784895
Random trial_4171.60.734126
Random trial_5159.1980.828584
Random trial_6158.6810.842351
Random trial_7157.0070.879218
Random trial_8166.790.766941
Random trial_9162.8740.793253
Random trial_10165.0530.788512
Random trial_11156.5520.861163
Random trial_12169.6790.738177
Random trial_13171.2760.736358
Random trial_14153.2220.873299
Random trial_15156.5650.890657
Random trial_16156.9050.85654
Random trial_17166.0720.771533
Random trial_18179.1710.655302
Random trial_19164.8990.776163