medchem

Applies medicinal chemistry filters for compound triage, using drug-likeness rules (Lipinski, Veber, CNS), structural alert catalogs (PAINS, NIBR, ChEMBL), complexity metrics, and the medchem query language for library filtering.

安装方式：打开 GenHub 客户端 → 技能市场 → 搜索「medchem」→ 一键安装。

来源：K-Dense-AI/scientific-agent-skills（MIT）