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Published in 2022 at "International Journal of Molecular Sciences"
DOI: 10.3390/ijms232012462
Abstract: With the exponential increase in publicly available protein structures, the comparison of protein binding sites naturally emerged as a scientific topic to explain observations or generate hypotheses for ligand design, notably to predict ligand selectivity…
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Keywords:
similarity;
chemistry;
estimating similarity;
protein pockets ... See more keywords