In quantitative photoacoustic tomography, the optical parameters of a target, most importantly the concentrations of chromophores such as deoxygenated and oxygenated hemoglobin, are estimated from photoacoustic data measured on the boundary of the target. In this work, a numerical approximation of a forward model for spectral quantitative photoacoustic tomography is constructed by utilizing the diffusion approximation for light propagation, the acoustic wave equation for ultrasound propagation, and spectral models of optical absorption and scattering to describe the wavelength dependence of the optical parameters. The related inverse problem is approached in the framework of Bayesian inverse problems. Concentrations of four chromophores (deoxygenated and oxygenated hemoglobin, water, and lipid), two scattering parameters (reference scattering and scattering power), and the Grüneisen parameter are estimated in a single-stage from photoacoustic data. The methodology is evaluated using numerical simulations in different full-view and limited-view imaging settings. The results show that, utilizing spectral data and models, the spectral optical parameters and the Grüneisen parameter can be simultaneously estimated. Furthermore, the approach can also be utilized in limited-view imaging situations.
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