[PNAS] Detecting life beyond Earth requires biosignatures that do not depend on the chemistry of known organisms.
Molecular assembly (MA), derived from Assembly Theory, quantifies how difficult it is to build a molecule from basic building blocks, linking complexity directly to selection and evolution.
Here, we show that MA can serve as a universal biosignature that is both interpretable and experimentally measurable. Unlike information-theoretic measures, MA can be inferred directly from mass spectrometry data without structural elucidation. We demonstrate this using a machine learning model trained on standardized single-stage (MS1) spectra, which predicts MA with three-fold lower error than baseline methods.
Simulated multistage (MSn) data reveal that small instrumental variations can double prediction error, highlighting the importance of calibration. These findings establish molecular assembly as a physically grounded, quantifiable biosignature measurable by mass spectrometry whose interpretation depends on careful control of instrumental effects, offering a scalable route to life detection on future planetary missions.
- Molecular assembly as a universal biosignature measurable by mass spectrometry, PNAS via PubMed
- Molecular assembly as a universal biosignature measurable by mass spectrometry, PNAS (open access)
Astrobiology,
