struct-predictor

Local protein structure prediction with AlphaFold, Boltz, or Chai. Compare predicted structures, compute RMSD, visualise 3D models.

25 stars

Best use case

struct-predictor is best used when you need a repeatable AI agent workflow instead of a one-off prompt.

Local protein structure prediction with AlphaFold, Boltz, or Chai. Compare predicted structures, compute RMSD, visualise 3D models.

Teams using struct-predictor should expect a more consistent output, faster repeated execution, less prompt rewriting.

When to use this skill

  • You want a reusable workflow that can be run more than once with consistent structure.

When not to use this skill

  • You only need a quick one-off answer and do not need a reusable workflow.
  • You cannot install or maintain the underlying files, dependencies, or repository context.

Installation

Claude Code / Cursor / Codex

$curl -o ~/.claude/skills/struct-predictor/SKILL.md --create-dirs "https://raw.githubusercontent.com/ComeOnOliver/skillshub/main/skills/ClawBio/ClawBio/struct-predictor/SKILL.md"

Manual Installation

  1. Download SKILL.md from GitHub
  2. Place it in .claude/skills/struct-predictor/SKILL.md inside your project
  3. Restart your AI agent — it will auto-discover the skill

How struct-predictor Compares

Feature / Agentstruct-predictorStandard Approach
Platform SupportNot specifiedLimited / Varies
Context Awareness High Baseline
Installation ComplexityUnknownN/A

Frequently Asked Questions

What does this skill do?

Local protein structure prediction with AlphaFold, Boltz, or Chai. Compare predicted structures, compute RMSD, visualise 3D models.

Where can I find the source code?

You can find the source code on GitHub using the link provided at the top of the page.

SKILL.md Source

# Struct Predictor

You are the **Struct Predictor**, a specialised agent for protein structure prediction and analysis.

## Core Capabilities

1. **Structure Prediction**: Run AlphaFold (ColabFold), Boltz-1, or Chai locally
2. **PDB Retrieval**: Fetch experimental structures from PDB via OpenBio
3. **Structure Comparison**: Compute RMSD, TM-score between predicted and reference structures
4. **Confidence Mapping**: Visualise pLDDT and PAE confidence metrics
5. **Report Generation**: Markdown with 3D renders, confidence plots, and comparison tables

## Dependencies

- `colabfold_batch` or `boltz` or `chai` (at least one local predictor)
- `biopython` (PDB parsing)
- Optional: `pymol` (3D rendering), `py3Dmol` (interactive visualisation)

## Example Queries

- "Predict the structure of this protein sequence: MKWVTF..."
- "Compare AlphaFold prediction of BRCA1 to the experimental PDB structure"
- "Show the pLDDT confidence plot for my predicted structure"
- "What is the RMSD between these two PDB files?"

## Status

**Planned** -- implementation targeting Week 4-5 (Mar 20 - Apr 2).

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