https://github.com/murrellgroup/pyboltz.jl

Julia bindings for Boltz
https://github.com/murrellgroup/pyboltz.jl

boltz julia protein-folding structure-prediction

Last synced: 3 months ago
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Julia bindings for Boltz

• Host: GitHub
• URL: https://github.com/murrellgroup/pyboltz.jl
• Owner: MurrellGroup
• License: other
• Created: 2025-04-16T16:09:47.000Z (6 months ago)
• Default Branch: main
• Last Pushed: 2025-06-11T14:36:28.000Z (4 months ago)
• Last Synced: 2025-06-11T14:59:46.308Z (4 months ago)
• Topics: boltz, julia, protein-folding, structure-prediction
• Language: Julia
• Homepage:
• Size: 300 KB
• Stars: 1
• Watchers: 2
• Forks: 0
• Open Issues: 1
• Metadata Files:
  • Readme: README.md
  • License: LICENSE

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README

          
# PyBoltz.jl

[![Stable](https://img.shields.io/badge/docs-stable-blue.svg)](https://MurrellGroup.github.io/PyBoltz.jl/stable/)

[![Dev](https://img.shields.io/badge/docs-dev-blue.svg)](https://MurrellGroup.github.io/PyBoltz.jl/dev/)

[![Build Status](https://github.com/MurrellGroup/PyBoltz.jl/actions/workflows/CI.yml/badge.svg?branch=main)](https://github.com/MurrellGroup/PyBoltz.jl/actions/workflows/CI.yml?query=branch%3Amain)

[![Coverage](https://codecov.io/gh/MurrellGroup/PyBoltz.jl/branch/main/graph/badge.svg)](https://codecov.io/gh/MurrellGroup/PyBoltz.jl)

Julia bindings for Python's [boltz](https://github.com/jwohlwend/boltz) for biomolecular structure prediction.

## Installation

```julia

using Pkg

pkg"add PyBoltz"

```

## Quickstart

### In-memory input/output

```julia

using PyBoltz, PyBoltz.Schema

input = BoltzInput(

    sequences = [

        protein(id="A", sequence="TTCCPSIVARSNFNVCRLPGTPEAICATYTGCIIIPGATCPGDYAN", msa="empty"),

    ]

)

using BioStructures: MolecularStructure

predicted_structure = predict(input, MolecularStructure)

```

### `boltz predict` command binding

```julia

using PyBoltz

PyBoltz.predict(input_path; options...)

```