Spectrum Atlas

Has this molecule been through the pipeline, and what came out?

Infrared spectra of molecules, corrected by a learned layer trained on coupled-cluster anchors — with the status and the provenance of every number. Polycyclic aromatics first.

Try naphthalene, C14H10 or c1ccc2ccccc2c1.

The status ladder — 14,248 molecules, counted at build

  1. 13,018
    Listed
  2. 1,219
    Cheap level done
  3. 0
    Correction predicted
  4. 0
    Spectrum predicted
  5. 10
    Anchored
  6. 1
    Validated

A molecule holds the highest rung it reaches. Counts come from the export, never from the page. What changed, and when.

Browse the atlas

Every molecule the pipeline lists, computes or anchors, with filters by status, size and elements.

How it works

The pipeline in five pictures, the three lessons, and every pre-registration.

The story so far

The lab notebook: what was tried, what failed, what was learned — in plain English.