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For each refinement, in addition to calculating the FSC between the refined model and the map it was refined against (the FSCwork, red curves in Figure S3), we also calculated a cross-validated FSC between the refined model and the other half map (the FSCtest curve green in Figure S3).
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Because the electron count for the NO in Cat-NO indicated that not all Cat molecules in the crystal have an equal amount of NO bound, occupational refinement becomes necessary in addition to B factor refinement.
An initial refinement process resulted in addition of 280 reactions, 81 metabolites and 27 genes to iRsp1095, while removing 23 reactions and 3 genes (Additional file 3: Tables S1 3).
DOI: http://dx.doi.org/10.7554/eLife.05767.019 Taken together, the ensemble structure refinement revealed that in addition to the open state, ligand-free K63-Ub2 also exists in at least two distinct closed states at a significant combined population.
In addition, refinement of nanoparticle designs can also allow incorporation of imaging agents, light delivery components and dosimetric components.
This information is also used to elucidate whether or not transport to secondary compartments is possible which triggers refinement in tier 2. In addition, default models currently applied for the different compartments are used to deduce the n-PECini.
In addition, refinement in the definition of BPD may allow more accurate prediction of important outcomes such as hospital length of stay and re-hospitalization after discharge, and further refine the relationship between BPD and neurodevelopmental outcome.
In addition, refinement of the SAMMs representing specific mutation mechanisms and increasing the number of MTMMs might also improve the tissue of origin classification, since maximizing the amount of contributory information should improve the prediction.
In addition, refinement of the SAMMs representing specific mutation mechanisms and increasing the number of MTMMs might also improve the tissue of origin classification, since maximizing the amount of contributory information should strengthen the prediction.
In addition, the refinement, the second refinement scoring function rescoring 2, and the saved poses were set to forcefield, none, and 10, respectively.
This phase involves reviewing assessment tasks, grading criteria ensuring that any refinements align with curriculum, in addition to institutional polices and assessment strategies.
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com