Biophysics · physics-informed ML

Physics-Constrained CD Spectral Inversion

Physics-Constrained CD Spectral Inversion
fig. — Physics-Constrained CD Spectral Inversion

Forward model maps protein secondary structure composition (helix/sheet/coil fractions) to CD spectra using reference basis spectra. A small physics-informed MLP inverts the problem — predicting composition from spectrum with a physics loss penalising spectral inconsistency and composition sum ≠ 1. Draws on hands-on CD experimental experience.

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