computational-chemistry-and-biology

v0.0.2

Run computational chemistry and structural biology calculations through Rowan MCP tools or rowan-python

Codex1 Skill

By RowanLicense: MIT21 GitHub starsUpdated last month

Directory evidence

Runtimes: Codex
Parsed components: 1 skill or MCP entry
Source updated: Aug 5, 2026
Manifest status: Canonical path parsed

The directory validates manifest shape and source location. It does not execute the plugin or provide a security endorsement. Review the indexing methodology →

Install computational-chemistry-and-biology for Codex

Installs for the current user

codex plugin marketplace add IchenDEV/agent-plugin-mkt
codex plugin marketplace upgrade agent-plugin-marketplace
codex plugin add computational-chemistry-and-biology@agent-plugin-marketplace

Paste and run these commands in a terminal with Codex. They add and refresh the PluginsMP catalog, then install this plugin.

The installer fetches third-party code from the source repository shown on this page. This directory validates manifest structure and source location, but does not perform a security audit; review the manifest, components, and source before installing.

Get the source manually

$ git clone https://github.com/rowansci/rowan-python

Clone the source repository, then follow its setup instructions to add the plugin to a compatible client. The repository root is the plugin root.

Plugin files

computational-chemistry-and-biology/

├── .codex-plugin/plugin.json
└── skills/computational-chemistry-and-biology/SKILL.md

Included Skills1

computational-chemistry-and-biologyskills/computational-chemistry-and-biology/SKILL.md

Run computational chemistry and structural biology calculations on the Rowan platform through Rowan MCP tools or the `rowan` Python package. Use when the user wants to run Rowan workflows, or mentions Rowan, computational chemistry, structural biology, or molecular or protein simulation.

Plugin manifests1

.codex-plugin/plugin.json

{
  "name": "computational-chemistry-and-biology",
  "version": "0.0.2",
  "description": "Run computational chemistry and structural biology calculations through Rowan MCP tools or rowan-python",
  "skills": "./skills/",
  "author": {
    "name": "Rowan",
    "email": "[email protected]",
    "url": "https://rowansci.com"
  },
  "homepage": "https://rowansci.com",
  "repository": "https://github.com/rowansci/rowan-python",
  "license": "MIT",
  "keywords": [
    "computational chemistry",
    "structural biology",
    "molecular simulation",
    "Rowan"
  ],
  "interface": {
    "displayName": "Rowan Computational Chemistry",
    "shortDescription": "Run computational chemistry and structural biology workflows with Rowan.",
    "longDescription": "Use Rowan to choose and run molecular and protein workflows, including quantum chemistry, docking, molecular dynamics, protein structure prediction, and cheminformatics. The bundled skill provides shared scientific and workflow guidance for Rowan MCP tools and rowan-python, including safe defaults, result retrieval patterns, and detailed references.",
    "developerName": "Rowan",
    "category": "Science",
    "capabilities": [
      "Read",
      "Compute"
    ],
    "websiteURL": "https://rowansci.com",
    "defaultPrompt": [
      "Run a Rowan calculation for this molecule.",
      "Help me choose a Rowan workflow for my chemistry question.",
      "Analyze this protein-ligand system with Rowan."
    ]
  }
}

For maintainers

If you maintain this plugin, link to this source-backed listing from your README so users can review its manifest and indexed components.

[computational-chemistry-and-biology on Agent Plugins Marketplace](https://pluginsmp.com/plugins/computational-chemistry-and-biology)