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Overview

Burrete Documentation

Burrete is a macOS desktop app, Finder Quick Look extension, source-built iPhone preview app, and local Codex plugin for molecular structure files.

It is built for the small daily loop of computational chemistry, structural biology, and cheminformatics work: open a structure, confirm what it is, switch renderer when needed, compare files in tabs, and recover quickly when Quick Look or renderer caches need maintenance.

Burrete is intentionally a compact utility, not a full molecular modeling environment.

What you can do

  • Press Space in Finder to preview supported molecular files.
  • Open the desktop workspace to inspect files in tabs, browse folders, search commands and structures, sketch molecules, and route files or molecule records with target-aware drag and drop.
  • Use Mol* for interactive 3D structures.
  • Search, select, edit, append, merge, and export SDF, SMILES, CSV, and TSV collections in RDKit-powered grids.
  • Use external xyzrender for formats that need artwork-style SVG rendering.
  • Run local xTB calculations for a small structure or selected molecular object.
  • Generate conformer ensembles with local CREST and optionally prune existing XYZ/SDF ensembles with PRISM.
  • Build the iPhone preview app from source when you need iOS document handoff.
  • Connect Codex to the local molecular workspace through focused skills and typed MCP tools.

Platform scope

SurfaceBest forImportant boundary
macOS desktopTabs, projects, drag and drop, grids, Ketcher, docking/FEP workspaces, xTB, CREST/PRISM, exports, and diagnosticsFull workflow surface; external engines must be installed locally.
Finder Quick LookA fast preview from Finder with SpacePreview surface, not the full desktop workflow.
iPhone source targetOpening supported documents from Files and inspecting mobile previewsBuilt from source; not included in the macOS Homebrew release.
Codex plugin and MCPTyped local workspace observation, opening, viewer control, and bounded report panelsPurpose-built tools, not arbitrary shell or unrestricted file access.
  1. Install Burrete
  2. Open your first file
  3. Choose the right surface
  4. Learn target-aware drag and drop
  5. Work with SDF and molecule collections
  6. Run xTB calculations
  7. Generate conformers with CREST
  8. Check supported formats
  9. Install the Codex plugin and MCP integration
  10. Fix Quick Look registration