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138 积分 2026-04-08 加入
AI-driven early-stage assessment strategy for rational design and synthesis of chitinase inhibitors
15小时前
已完结
Most Ligand-Based Classification Benchmarks Reward Memorization Rather than Generalization
16小时前
已完结
Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling research
16小时前
已完结
Extended-Connectivity Fingerprints
16小时前
已完结
Random forest: a classification and regression tool for compound classification and QSAR modeling
16小时前
已完结
Identification of Triazolo-quinazolinone Derivatives as Novel and Potent Chitinase OfChi-h Inhibitors Based on Structure-Based Virtual Screening
16小时前
已完结
Structure-Based Virtual Screening, Compound Synthesis, and Bioassay for the Design of Chitinase Inhibitors
16小时前
已完结
Decade of research on insect chitinase inhibitors: insights from molecular structure to biological function
16小时前
已完结
通过基于分子对接的生物层干涉虚拟筛选鉴定天然化合物作为 SARS-CoV-2 进入抑制剂
1个月前
已完结
生成式人工智能增强的虚拟筛选:一种识别新型ROCK2抑制剂的混合策略
1个月前
已完结