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. 2022 Nov 17;9:875424. doi: 10.3389/fmolb.2022.875424

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Copyright © 2022 Salin, Hariono, Khalili, Zakaria, Saqallah, Mohamad Taib, Kamarulzaman, Wahab and Khawory.

This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms.

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Structure-based pharmacophore generation of 22a employing 5 hydrogen bond acceptors (HBA; red), 3 hydrogen bond donors (HBD; green), and 1 hydrophobic (yellow) feature in (A) 3D and (B) 2D visualisations.