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. Author manuscript; available in PMC: 2014 Dec 12.
Published in final edited form as: J Phys Chem B. 2013 Nov 4;117(49):10.1021/jp4064214. doi: 10.1021/jp4064214

Table 1.

Parameter Estimates for 3D Simulation Data. In each case, a time series consisting of 1 × 105 observations uniformly spaced by 4ms was simulated to create draws from the stationary distribution of a 3D model. Parameters were estimated by dividing the long stationary signal into windows using various schemes. Case 1: Computed average and standard deviation (reported in parenthesis) of 3D model estimated with 400 observations per window; Case 2: Results with 1D model estimated with 400 observations (interaction terms Bxy, Bxz, Byz are set to zero); Case 3 and 4: Correspond to Case 1 and 2 except using a window of size 1600 (resulting in a larger sample size for each parameter estimate).

Case 1 2 3 4 Truth
Ax −0.003 (0.008) −0.000 (0.006) 0.000 (0.003) 0.001 (0.002) 0
Ay 0.003 (0.015) −0.000 (0.007) 0.000 (0.009) −0.000 (0.001) 0
Az 0.003 (0.031) −0.001 (0.004) 0.009 (0.014) −0.001 (0.004) 0
Bxx −10.735 (3.236) −3.896 (0.889) −9.790 (1.138) −3.586 (0.556) −10
Bxy 10.542 (3.267) - 9.825 (1.442) - 10
Bxz −0.597 (3.080) - −0.140 (1.941) - 0
Byy −16.319 (4.071) −5.879 (1.245) −15.190 (2.005) −5.397 (0.519) −15
Byz 1.049 (2.959) - 0.351 (1.807) - 0
Bzz −45.543 (14.190) −42.906 (11.842) −43.790 (4.924) −42.353 (4.107) −40
Cx 0.209 (0.050) 0.159 (0.025) 0.209 (0.012) 0.157 (0.007) 0.2
Cy 0.148 (0.028) 0.121 (0.016) 0.143 (0.016) 0.119 (0.009) 0.15
Cz 0.103 (0.033) 0.106 (0.042) 0.095 (0.015) 0.098 (0.015) 0.10
Rx 0.020 (0.002) 0.021 (0.001) 0.020 (0.001) 0.021 (0.001) .020
Ry 0.015 (0.001) 0.016 (0.001) 0.015 (0.001) 0.016 (0.001) 0.015
Rz 0.010 (0.002) 0.010 (0.002) 0.010 (0.001) 0.010 (0.001) 0.010