Sentence examples for pose 1 from inspiring English sources
Figure 9A presents the findings for pose 1 docked onto the A1 monomer, and Figure 9C presents data for pose-1 docked onto the dimer (A1-B1).
The MolDock score of pose 1 was lower than that of the other four poses (pose 1 = −117.85, pose 2 = −117.10, pose 3 = −107.27, pose 4 = −105.83, and pose 5 = −104.92 Kcal/mol), indicating the structure in pose 1 was superior.
The cationic nitrogen atom of the ligand is located closer to the aromatic plane of W145 compared to pose 1, which could result in a stronger cation π interaction with W145 (distance to atom CD2 of W145 = 4.9 Å).
Often, however, they must hold a pose 20 to 25 minutes before a break.
The performance of all the descriptors was analyzed from the perspective of matching gallery and probe images with the following scenarios: (1) neutral-neutral (expressions), (2) neutral-smile, (3) smile-smile, (4) frontal pose - non-frontal pose, (5) non-frontal pose - frontal pose, (6) non-frontal pose - non-frontal pose, (7) no glasses-with glasses, and (8) eyes open-eyes closed.
FastSLAM2.0 used a particle filter to model the uncertainty of the robot pose [20].
It optimally aligns hydrogens, identifies favorable tautomeric and protonation states, and evaluates the predicted pose [3].
In addition, the n−3 and n−6 fatty acids pose 10.4 and 10.9/100 g of the total fatty acids.
For ligand 1, two poses actually capture the correct binding mode of the molecules within BRD4(1) binding pocket (poses 1-a and 1-c), despite the fact pose 1-a appears to be substantially different from the crystal (RMSD of 8.4 Å).
The extensive sampling in the unrestrained simulations means that such deviation from the crystal structure does not affect the free energy result (while it does affect the docking score), and the ligand is still predicted to be a strong binder when starting from pose 1-a (ESI Table 4 †).
