Agent skill

Workflow

by Hello-QM in Hello-QM/catgo-LRG

A skill your agent uses when the user asks to create, build, inspect, validate, or run computational workflows, DAG pipelines, relaxation→static chains, NEB/IRC workflows, or HPC job submission flows.

AGPL-3.0Auto-check passed

Install Workflow

skills CLI
$ npx skills add Hello-QM/catgo-LRG --skill workflow -a claude-code

Project install by default; add -g for ~/.claude/skills/.

GitHub CLI
$ gh skill install Hello-QM/catgo-LRG workflow --agent claude-code

Project scope by default; add --scope user for a personal install. Needs GitHub CLI 2.90.0 or later (public preview).

Manual copy
$ git clone --depth 1 https://github.com/Hello-QM/catgo-LRG.git skills-src && mkdir -p .claude/skills && cp -r skills-src/catbot-plugin/skills/workflow .claude/skills/workflow && rm -rf skills-src

Use ~/.claude/skills/ instead of .claude/skills for a personal install. The folder must contain SKILL.md.

Claude Code skills documentation · loads skills from .claude/skills/

Facts

Skill name
workflow
GitHub stars
205
Token cost
~802 tokens
SKILL.md length
302 words
Files
1
Skills in repo
75
Repo updated
First seen
Licence
AGPL-3.0

At a glance

A skill your agent uses when the user asks to create, build, inspect, validate, or run computational workflows, DAG pipelines, relaxation→static chains, NEB/IRC workflows, or HPC job submission flows.

  • Works in 5 steps: Discover → Create → Add Nodes → …
  • The user asks to create
  • SKILL.md covers Current Reality, Quick Reference, Safe Build Sequence and Do Not Do These, plus 1 more section
  • Instructions only: no scripts, shell commands, URLs or credentials in SKILL.md

What it does

Workflow is an agent skill from Hello-QM/catgo-LRG. Use when the user asks to create, build, inspect, validate, or run computational workflows, DAG pipelines, relaxation→static chains, NEB/IRC workflows, or HPC job submission flows.

Its SKILL.md is about 800 tokens, which your agent loads only when the skill is triggered. It is a single SKILL.md file with no bundled scripts.

The repository describes itself as: AI-driven workbench for computational materials science — interactive 3D structure viewer, natural-language CatBot assistant, visual DAG workflow engine, HPC job submission… The licence is AGPL-3.0.

When your agent uses it

  • The user asks to create
  • Run computational workflows
  • Relaxation→static chains
  • NEB/IRC workflows

Example prompts

  • “/workflow”

Workflow steps

5 steps, taken from the step headings in SKILL.md.

  1. Discover
  2. Create
  3. Add Nodes
  4. Set Parameters
  5. Connect Carefully

What it can do on your machine

Read from SKILL.md and the folder at commit fd6291b. It shows what the files ask for, not the result of running them.

  • Tool permissions

    Pre-approves nothing: there is no allowed-tools line, so your agent's usual permission prompts apply.

    From allowed-tools in the SKILL.md frontmatter.

  • Runs code

    No scripts in the folder and no shell commands in SKILL.md (its code samples are json).

    From the folder's file list and the shell code blocks in SKILL.md.

  • Network

    No URLs in SKILL.md.

    From URLs in SKILL.md, links to its own repository left out.

  • Credentials

    Names no API keys, tokens, secrets or passwords.

    From names ending in _API_KEY, _TOKEN, _SECRET, _KEY or _PASSWORD in SKILL.md.

Context cost

Workflow loads about 802 tokens when it runs. Until then it costs about 47 tokens; SKILL.md has 302 words of instructions outside code blocks.

Always · name and description, kept in context so the agent knows when to use it
~47
When it runs · the whole SKILL.md, loaded when a task matches
~802

Estimates: characters ÷ 4, the usual rule of thumb; real counts depend on the model's tokenizer. Scripts and assets cost tokens only if the agent reads them.

Safety

Auto-check passed

The automated check found no risky patterns in SKILL.md.

Automated static check — not a guarantee. Review scripts before installing. It scans the text of SKILL.md for risky patterns (piping downloads into a shell, reading credential files, hidden Unicode, destructive commands); files beside SKILL.md are not scanned.

SKILL.md

The full file from Hello-QM/catgo-LRG at commit fd6291b, republished under its AGPL-3.0 licence (© Hello-QM). 302 words, ~802 tokens.

Download SKILL.mdSave it as .claude/skills/workflow/SKILL.md (or your agent's skills folder).
name
workflow
description
Use when the user asks to create, build, inspect, validate, or run computational workflows, DAG pipelines, relaxation→static chains, NEB/IRC workflows, or HPC job submission flows.

CatGO Workflow Skill

All MCP workflow operations use the single catgo_workflow tool with an action parameter.

Current Reality

Do not assume old workflow docs are still correct.

Important current behavior:

  • create creates a workflow that already contains one structure_input node.
  • run starts execution immediately. It does not open a confirmation dialog.
  • connect defaults both handles to structure if omitted.
  • node_types is only a discovery list. It does not give full node schema.

Quick Reference

ActionPurposeRequired Params
listList all workflows—
templatesList available templates—
node_typesList node types by categorycategory?
createCreate workflowname, template_id?
getRead workflow graphworkflow_id
add_nodeAdd nodeworkflow_id, node_type, params?
remove_nodeRemove nodeworkflow_id, node_id
connectConnect nodesworkflow_id, from_id, to_id, from_handle?, to_handle?
set_paramsUpdate paramsworkflow_id, node_id, params
validateValidate graphworkflow_id
runStart execution immediatelyworkflow_id, run_config?
pausePause workflowworkflow_id
resumeResume workflowworkflow_id, run_config?
statusGet run statusworkflow_id
step_errorGet failure detailworkflow_id, step_id

Safe Build Sequence

1. Discover
  • Call node_types first for coarse discovery.
  • Call templates if the user wants a preset.
2. Create
json
{"action": "create", "name": "TiO2 slab workflow"}

Immediately after create:

  • Call get
  • Check the graph
  • Reuse the auto-created structure_input unless the workflow truly needs multiple independent inputs
3. Add Nodes
json
{"action": "add_node", "workflow_id": "...", "node_type": "geo_opt"}
{"action": "add_node", "workflow_id": "...", "node_type": "single_point"}
4. Set Parameters
json
{"action": "set_params", "workflow_id": "...", "node_id": "...", "params": {"software": "vasp", "ENCUT": 520}}
5. Connect Carefully

Only omit handles when both sides are obviously single-structure nodes.

Safer form:

json
{
  "action": "connect",
  "workflow_id": "...",
  "from_id": "n1",
  "to_id": "n2",
  "from_handle": "structure",
  "to_handle": "structure"
}

Do Not Do These

  • Do not assume create returns an empty graph.
  • Do not blindly add another structure_input after create.
  • Do not assume connect can guess the right handle for multi-port nodes.
  • Do not treat validate warnings as harmless.
  • Do not call run before the user has provided a valid run configuration when HPC settings matter.

Minimal Reliable Pattern

  1. node_types
  2. create
  3. get
  4. add_node
  5. set_params
  6. connect with explicit handles when needed
  7. validate
  8. get
  9. run

© Hello-QM, AGPL-3.0. Rendered from Markdown: HTML in the file is shown as text, images as links, and headings moved down two levels. Raw file

Files

Just SKILL.md in catbot-plugin/skills/workflow of Hello-QM/catgo-LRG.

Open the folder on GitHubat commit fd6291b

Compare with similar skills

Workflow next to the 5 skills that share the most tags, products or categories with it. Stars are the repository's; “used in” counts other GitHub owners with a copy.

Workflow compared with similar skills
SkillStarsUsed inTokensAuto-checkLicenceRepo updated
Workflow this skillHello-QM/catgo-LRG205—~802Automated safety check: PassAGPL-3.0
Inspectagentevals-dev/agentevals162—~534Automated safety check: PassApache-2.0
InspectArman-Kudaibergenov/1c-ai-development-kit166—~3.4kAutomated safety check: NotesAGPL-3.0
Inspectbluzir/claude-code-design106—~1.1kAutomated safety check: PassNone
Node Inspect Debuggeropenclaw/openclaw392k1 repos~894Automated safety check: PassMIT
Blender Motion State Inspectionaffaan-m/ECC275k1 repos~2kAutomated safety check: PassMIT

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Questions about Workflow

What does Workflow do?

A skill your agent uses when the user asks to create, build, inspect, validate, or run computational workflows, DAG pipelines, relaxation→static chains, NEB/IRC workflows, or HPC job submission flows. Workflow is an agent skill from Hello-QM/catgo-LRG. Use when the user asks to create, build, inspect, validate, or run computational workflows, DAG pipelines, relaxation→static chains, NEB/IRC workflows, or HPC job submission flows.

When should I use Workflow?

Workflow fits situations like: the user asks to create; run computational workflows; relaxation→static chains; NEB/IRC workflows.

How do I install Workflow in Claude Code?

Run `npx skills add Hello-QM/catgo-LRG --skill workflow -a claude-code`. Or copy the skill folder (catbot-plugin/skills/workflow in Hello-QM/catgo-LRG) into .claude/skills/workflow in your project. Claude Code loads it when a task matches its description.

How do I install Workflow in Codex?

Run `npx skills add Hello-QM/catgo-LRG --skill workflow -a codex`. Or copy the skill folder (catbot-plugin/skills/workflow in Hello-QM/catgo-LRG) into .agents/skills/workflow in your project. Codex loads it when a task matches its description.

Can I use Workflow in Cursor, Gemini CLI or GitHub Copilot?

Cursor, Gemini CLI, GitHub Copilot and OpenCode also load SKILL.md folders. With the skills CLI, run `npx skills add Hello-QM/catgo-LRG --skill workflow -a cursor` (or -a gemini-cli, github-copilot or opencode for the others). To copy it by hand, put the folder in .cursor/skills/workflow, .gemini/skills/workflow, .github/skills/workflow and .opencode/skills/workflow in your project.

What does Workflow need to run?

SKILL.md names no scripts, command-line tools or credentials: Workflow is instructions for the agent only.

Does Workflow access the network?

SKILL.md contains no URLs. Any network use would come from the scripts or tools the agent runs. This is read from the text; nothing was executed.

Is Workflow safe to install?

Our automated static check of SKILL.md found no risky patterns, such as piping downloads into a shell, reading credential files or hidden Unicode. It is not a guarantee. Review the folder before installing.

What licence does Workflow use?

Workflow is published under the AGPL-3.0 licence (the repository's licence). It allows redistribution, so the full SKILL.md is shown on this page.

How many tokens does Workflow use?

About 802 tokens (SKILL.md is roughly 3.2k characters). Agents keep only the skill's name and description in context until a task matches; then they load SKILL.md in full.

What are the alternatives to Workflow?

Skills that share tags, products or a category with Workflow: Inspect (agentevals-dev/agentevals, 162 stars), Inspect (Arman-Kudaibergenov/1c-ai-development-kit, 166 stars), Inspect (bluzir/claude-code-design, 106 stars) and Node Inspect Debugger (openclaw/openclaw, 392k stars). The comparison table on this page puts their stars, adoption, token cost, safety result and licence side by side.

Who maintains Workflow?

Hello-QM (a GitHub user) maintains it in Hello-QM/catgo-LRG, which has 205 GitHub stars. The repository holds 75 skills in this directory. The repository was last updated on September 22, 2026.

Source: Hello-QM/catgo-LRG on GitHub. Facts on this page come from the repository at the commit we read; the author's words are quoted as theirs.