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The modeling analysis suggests possible solutions to postpone and prevent TR propagation.
The modeling analysis suggests that in addition to n-alkyl beta-scission chemistry, alkyl peroxy radical chemistry contributes significantly to the formation of these alkenes.
Furthermore, a competitive colchicine binding assay and molecular modeling analysis suggests that these conjugates bind to the tubulin successfully at the colchicine binding site.
This modeling analysis suggests distinct functional responses to different biochemical mechanisms that will be the subject of future studies.
In conclusion, this molecular modeling analysis suggests that although Asp316 and Thr338 are located at different sites in the primary sequence, they are spatially close and might interact with each other; the mutation in either site could affect the stability of its adjacent loop.
Structural modeling analysis suggests that GTS1 folds into a β-propeller with seven pseudo symmetrically arranged blades around a central axis.
The computational modeling analysis suggested that Mar non-covalently bound to active sites of proteasome β5 and β1 subunits, resulting in a non-competitive inhibition.
Based on the results of this incubation experiment and the modeling analysis, we suggest that power function models should be used to describe the dynamics of recalcitrant carbon pools.
The modeling approach complements traditional methods of data analysis, suggesting non-intuitive network relationships and guiding future experiments.
In addition, with the evidence obtained from the bioinformatic tools, the structure-modeling analysis strongly suggests that this variant could affect the protein function.
Molecular modeling analysis of APLs suggested a critical role of APLs for allosteric regulation in this region with binding sites for ATP and 3-PGA.
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