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Protein structure prediction with MSA v1.0.0

Use this resource to predict a protein structure from an MSA alignment with OpenFold3

New

  • 488 downloads
  • 139 likes
  • 101 saves

Free

Install with the CLI

In a terminal, from the folder you want:

npx --yes palatekit@latest install msa-protein-structure-pipeline

With no option, the skill goes to ~/.agents/skills/; add --agent claude-code (or codex, cursor…) to target an agent.

First time: connect the CLI with

npx --yes palatekit@latest login

The agent searches for homologs with MSA-Search, extracts the A3M alignment and counts sequences, then passes it to OpenFold3 for prediction. The sequence and alignment are sent to NVIDIA-hosted APIs on every call; use local NIM containers for confidential sequences. You get a predicted structure and its alignment.

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Updated November 2, 2026

Card for the “Protein structure prediction with MSA” skill

Details

Generates with
Your agent's model
Licence
CC-BY-4.0

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What you get

  • SKILL.md: two-step procedure
  • evals/evals.json: evaluation cases
  • skill-card.md: skill card

Good fit for

  • You want a structure prediction that uses evolutionary context
  • Your sequence has few close homologs in the PDB

Not for

    Tags

    • protein
    • MSA
    • OpenFold3
    • structure

    About

    You say

    “Predict the structure of this protein sequence using an MSA alignment.”

    Card for the “Protein structure prediction with MSA” skill

    Skill published by nvidia under the CC-BY-4.0 license, delivered in its original version.

    Show more

    How to use it

    1. Install the skill in your agent's skills folder
    2. Ask your agent to predict a protein structure from an MSA alignment with OpenFold3
    3. Review and adjust the result

    Content preview

    Files

    • BENCHMARK.md7.8 KB
    • evals/evals.json7.9 KB
    • LICENSE11.3 KB
    • NOTICE-PALATEKIT.md0.5 KB
    • skill-card.md4.1 KB
    • SKILL.md6.6 KB
    • skill.oms.sig4.5 KB

    Origin and licence

    Listed unmodified

    Author
    nvidia
    Source
    github.com/nvidia/skills/tree/ca116d60beafe1b4459f0ab790b7b450912c56b0/skills/bionemo-msa-structure-prediction-pipeline
    Licence
    CC-BY-4.0

    Notice

    « msa-structure-prediction-pipeline » (nvidia, CC-BY-4.0) livré dans sa version d'origine : fiche en français et en anglais par PalateKit.

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