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Enables natural language interaction with computational chemistry tools including molecule building, electronic structure calculations, geometry optimization, vibrational spectroscopy, and molecular dynamics, powered by RDKit, PySCF, and ASE.
复制安装指令，让 AI 自动完成配置 · 推荐新手
"ypotheto-compchem-mcp" 暂无可直接复制的安装信息，请查看页面文档或源码仓库。