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Pharmacophore Modeling for Targets with Extensive Ligand Libraries: A Case Study on SARS-CoV-2 Mpro
Published on: September 26, 2025
LuQi Huang1, PeiGen Xiao, LanPing Guo
1Institute of Chinese Materia Medica, China Academy of Chinese Medical Sciences, Beijing, 100700, China. huangluqi@263.net
Molecular pharmacognosy aids in identifying medicinal resources and understanding plant evolution. It also addresses conservation, active component biosynthesis, and the molecular basis of top-grade herbs.
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