Antimicrobial resistance (AMR) poses a growing threat to global public health, particularly for priority pathogens such as Staphylococcus aureus (SA) and Neisseria gonorrheae (NG), for which therapeutic options are increasingly limited. Although deep learning has accelerated antibiotic discovery, existing approaches...
Zhi-Jie Pan, Xin Yang, Wen-Chi Ge et al.· Journal of Chemical Informat...· 0 citations
Overall, AbAgMut-GNN is best viewed as a task-oriented computational tool for trend-level mutation ranking and pre-experimental candidate prioritization rather than as a high-precision substitute for quantitative biophysical measurement.
Wen-Chi Ge, Qi-Jia Yu, Jin-Cen Shuai et al.· Journal of Chemical Informat...· 0 citations
This review elucidates the paradigm shift in drug discovery from serendipitous exploration to rational, structure-driven polypharmacological molecular engineering, thereby providing a clear, structured guide for navigating the complexities of next-generation therapeutics.
Tianming Han, Zhijie Pan, Wenchi Ge et al.· 0 citations
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