Ku Kang

Benchmarking Affinity-Based Docking for Irreversible Acetylcholinesterase Inhibitors: A Physics-Informed Reactivity Framework for Stereoselective Potency Prioritization

Abstract Irreversible organophosphorus inhibitors of acetylcholinesterase (AChE) act by covalent phosphylation of the catalytic serine, yet their computational prioritization is often based on affinity scores from noncovalent docking. We benchmark that assumption against a curate...

Low-methoxyl pectin–Ca2＋ gelation as a sample solidification protocol for marine radioactivity monitoring by HPGe gamma spectrometry

Marine radioactivity monitoring requires rapid, reliable sample preparation methods that remain functional aboard ships and other mobile platforms. Liquid seawater samples, however, are prone to geometric instability and spillage during vessel motion, which degrade HPGe gamma spe...