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A recently discovered, structurally unique marine sponge-derived brominated alkaloid, -agelastatin A (AglA), possesses potent antitumor activity.
In summary, several 2D and 3D virtual screening approaches have successfully discovered structurally diverse natural product PPARγ activators, thereby indicating natural products as a rich source for novel PPARγ agonists.
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We expect this study will serve as a guide for future genomic mining projects to discover structurally diverse mushroom-derived polyketides.
This finding opens the possibility of discovering structurally more diverse DAAO ligands.
An unconventional HLA-A2-restricted epitope HBc141 149 was discovered and structurally characterized by crystallization analysis.
This study demonstrates the systematic use of pharmacophore technologies to discover novel structurally diverse inhibitors based on lead molecules that would exhibit poor characteristics in vivo.
A major drawback, however, is that template matching cannot discover yet structurally unknown complexes.
Because the newly discovered inhibitors are structurally diverse and have the desirable physicochemical properties as a drug candidate, they deserve a further investigation as anti-asthmatic drugs.
These newly discovered inhibitors are structurally unrelated to the ones known so far and provide useful scaffolds to develop compounds with more desirable properties.
Because the newly discovered inhibitors are structurally diverse and have desirable physicochemical properties as a drug candidate, they deserve further investigation as anticancer drugs.
Because the newly discovered inhibitors are structurally diverse and reveal a significant potency with IC50 values lower than 50 μM, all of them can be considered for further development by structure activity relationship studies.
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