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After generating biologically relevant protonation (pH = 7 ± 2) and tautomeric states using LigPrep and EPIK [55, 56, 61, 62], we obtained a total of 20,097 initial poses for docking at the HLA-B*57 01 HLA-B*57 01
The initial closed and open structures were taken from the first monomers of the InhA NAD+: PT70 complex (PDB code 2X23(14)) and the InhA NAD+: C16-NAC complex (PDB code 1BVR(18)), respectively, while DOCK 6.3 was used to generate the initial poses for the other inhibitors.
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Moreover, even if the condition is changed (for example, the initial pose of the object varies), the neural network may be able to drive the robot to complete the task due to its generalization ability.
However, it is impossible for a robot to adapt to nontrivial variations in the initial pose of the object or unexpected fluctuations in the pose of the object during manipulation relying on only internal sensors.
Figure 16a shows the initial pose of the HRP-4.
Scoring window for keeping initial poses was kept at 100 poses.
We subsequently carry out a pseudo-prospective study where we repeat the exercise with traditional docking methods to give the initial poses without using any structural information for the protein ligand complexes.
Using these initial poses, our aim is 2-fold.
This work addresses the comparative assessment of initial pose estimation techniques for monocular navigation to enable formation-flying and on-orbit servicing missions.
In practice, it is unrealistic for a robot to move to the initial pose after reaching the target position every time.
Keep the position for 15 to 30 seconds and return to the initial pose.
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