chemistry-skills

9 chemistry skills. Trigger: chemical structure analysis, reaction prediction, molecular modeling. Design: computational chemistry tools and cheminf…

它会碰到什么

扫了多少10 个文本文件，59 KB

它会碰到什么执行命令联网

命中总数15 处

命中统计严重 0 · 高 0 · 中 0 · 低 0

这一栏是扫描器报的事实，不是结论。命中多不等于有毒（安全工具、规则库、示例脚本本来就会包含危险写法），命中少也不等于干净。它和你手上的凭据、文件、网络有什么关系，需要你自己看。

Select the skill matching the user's need, then read its SKILL.md.

| Skill | Description |

|-------|-------------|

| [cactus-cheminformatics-guide](./cactus-cheminformatics-guide/SKILL.md) | PNNL cheminformatics LLM agent for molecular analysis |

| [catalysis-hub-api](./catalysis-hub-api/SKILL.md) | Query computational catalysis reaction data via Catalysis Hub GraphQL |

| [chemeagle-guide](./chemeagle-guide/SKILL.md) | Multi-agent system for chemical literature information extraction |

| [chemgraph-agent-guide](./chemgraph-agent-guide/SKILL.md) | Automate molecular simulations with the ChemGraph agentic framework |

| [computational-chemistry-guide](./computational-chemistry-guide/SKILL.md) | DFT, molecular simulation, and reaction prediction tools for chemists |

| [molecular-dynamics-guide](./molecular-dynamics-guide/SKILL.md) | Molecular dynamics simulation setup, execution, and trajectory analysis |

| [pubchem-api-guide](./pubchem-api-guide/SKILL.md) | Search PubChem for chemical compounds, structures, and bioassay data |

| [retrosynthesis-guide](./retrosynthesis-guide/SKILL.md) | Retrosynthetic analysis and computational reaction prediction |

| [spectroscopy-analysis-guide](./spectroscopy-analysis-guide/SKILL.md) | Spectral data analysis for NMR, IR, mass spectrometry, and UV-Vis |

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本站把开放许可（MIT / Apache 等）的技能按仓库打包整理到网盘，点一下转存到你自己的网盘，不用一个个从 GitHub 拉。许可未声明的技能只给原始仓库链接，不打包。

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原文件路径skills/43-wentorai-research-plugins/skills/domains/chemistry/SKILL.md