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The experimental dataset was taken from the DUD database [43, 44], which was designed for testing docking algorithms by providing challenging decoys.
After the clotting cascade network testing, docking validations also should be carried out.
CAPRI is a blind prediction experiment designed to test docking and scoring procedures [20], [21].
It was launched unmanned but was designed to be habitable, to test docking with other craft, and to be used for conducting experiments.
The DUD set is designed to help test docking algorithms by providing challenging decoys.
The Chinese unmanned spacecraft Shenzhou-8 returned to Earth today after completing its mission to test docking maneuvers in the Earth's orbit.
As per the docking results (Table 1), all the 29 compounds tested docked into the active site of the target protein molecule successfully, with a binding energy ranging between -10.4 to -6.4 K.cal./mol./mol
Next, our model was used to dock a test set of 13 drugs at HLA-B*57 01 HLA-B*57 01d their predicted binding andinities.
On June 25th, it collided with an unmanned Progress service vehicle during a test of a new docking technique.
Cognate docking has been used as a test for pose prediction quality in docking engines for decades.
A test series of carbamate analogues were docked into the identified sites to predict the most favourable binding location.
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