nlmixr version used for fitting: 2.0.6 mkin version used for pre-fitting: Dummy 0.0 for testing R version used for fitting: Dummy R version for testing Date of fit: Dummy date for testing Date of summary: Dummy date for testing Equations: d_parent/dt = - ((k1 * g * exp(-k1 * time) + k2 * (1 - g) * exp(-k2 * time)) / (g * exp(-k1 * time) + (1 - g) * exp(-k2 * time))) * parent d_m1/dt = + f_parent_to_m1 * ((k1 * g * exp(-k1 * time) + k2 * (1 - g) * exp(-k2 * time)) / (g * exp(-k1 * time) + (1 - g) * exp(-k2 * time))) * parent - k_m1 * m1 Data: 508 observations of 2 variable(s) grouped in 15 datasets Degradation model predictions using RxODE Fitted in test time 0 s Variance model: Constant variance Mean of starting values for individual parameters: parent_0 log_k_m1 f_parent_qlogis log_k1 log_k2 100.74 -5.43 -0.05 -2.85 -4.57 g_qlogis -0.15 Mean of starting values for error model parameters: sigma_parent sigma_m1 3 3 Fixed degradation parameter values: None Results: Likelihood calculated by gauss3_1.6 AIC BIC logLik 2465 2525 -1219 Optimised parameters: est. lower upper parent_0 100.54 99.7 101.40 log_k_m1 -5.44 -5.6 -5.24 f_parent_qlogis -0.06 -0.2 0.05 log_k1 -2.81 -3.0 -2.65 log_k2 -4.62 -4.8 -4.41 g_qlogis -0.14 -0.4 0.17 Correlation: prnt_0 lg_k_1 f_prn_ log_k1 log_k2 log_k_m1 -0.224 f_parent_qlogis -0.401 0.335 log_k1 0.119 0.083 0.019 log_k2 -0.019 0.237 0.142 0.395 g_qlogis 0.083 -0.282 -0.218 -0.532 -0.544 Random effects (omega): eta.parent_0 eta.log_k_m1 eta.f_parent_qlogis eta.log_k1 eta.parent_0 0.05 0.0 0.00 0.00 eta.log_k_m1 0.00 0.1 0.00 0.00 eta.f_parent_qlogis 0.00 0.0 0.03 0.00 eta.log_k1 0.00 0.0 0.00 0.05 eta.log_k2 0.00 0.0 0.00 0.00 eta.g_qlogis 0.00 0.0 0.00 0.00 eta.log_k2 eta.g_qlogis eta.parent_0 0.00 0.0 eta.log_k_m1 0.00 0.0 eta.f_parent_qlogis 0.00 0.0 eta.log_k1 0.00 0.0 eta.log_k2 0.08 0.0 eta.g_qlogis 0.00 0.1 Variance model: sigma_parent sigma_m1 4 1 Backtransformed parameters: est. lower upper parent_0 1e+02 1e+02 1e+02 k_m1 4e-03 4e-03 5e-03 f_parent_to_m1 5e-01 5e-01 5e-01 k1 6e-02 5e-02 7e-02 k2 1e-02 8e-03 1e-02 g 5e-01 4e-01 5e-01 Resulting formation fractions: ff parent_m1 0.5 parent_sink 0.5 Estimated disappearance times: DT50 DT90 DT50back DT50_k1 DT50_k2 parent 27 170 51 12 70 m1 160 532 NA NA NA