Maximizing the Performance of Similarity-Based Virtual Screening Methods by Generating Synergy from the Integration of 2D and 3D Approaches
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DOI: 10.3390/ijms23147747
Abstract: Methods for the pairwise comparison of 2D and 3D molecular structures are established approaches in virtual screening. In this work, we explored three strategies for maximizing the virtual screening performance of these methods: (i) the… read more here.
Keywords: maximizing performance; screening; virtual screening; integrated approach ... See more keywords