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. Author manuscript; available in PMC: 2020 May 7.
Published in final edited form as: Nanoscale. 2019 Nov 28;11(46):22515–22530. doi: 10.1039/c9nr06327g

Table 5.

Classifier metrics using nanoparticle trajectories to predict agarose gel concentration (0.4%, 0.6%, 0.8%, 1.0%, and 1.2%). From left to right: (1) sample size of training and test datasets after spatial checkerboard split, (2) pore obstruction model with parameters fitted using mean diffusion coefficients from each agarose concentration strata (3) pore obstruction model using locally averaged diffusion coefficients fitted using mean diffusion coefficients from each agarose concentration strata, (4) pore obstruction model with reduced resolution (0.4%, 0.8%, 1.2% agarose) using locally averaged diffusion coefficients fitted using mean diffusion coefficients from each agarose concentration strata, (5) neural network predictor trained with principal components from trajectory feature analysis using both individual and locally averaged geometric features, (6) neural network trained with principal components from trajectory feature analysis with reduced resolution (0.4%, 0.8%, 1.2% agarose)

Sample size
Obstruct. model
Overall
Obstruct. modela
Overall
Obstruct. Modelb
Overall
Obstruct. Modela,b
Overall
Neural networkb
Neural
Networka,b
Training Test Training Test Training Test
0.4% 44 643 45 388 0.409 0.420 0.623 0.712 0.910 0.695 0.992 0.834
0.6% 42 941 41 812 0.061 0.235 0.843 0.486
0.8% 46 913 45 652 0.164 0.316 0.121 0.228 0.805 0.329 0.974 0.569
1.0% 63 001 65 820 0.151 0.027 0.880 0.395
1.2% 122 390 121 818 0.304 0.365 0.502 0.524 0.972 0.702 0.996 0.837
Avg/tot 180 610 181 437 0.218 0.367 0.302 0.488 0.882 0.521 0.987 0.747
a

Predictor trained using only 0.4%, 0.8%, and 1.2% datasets (reduced resolution).

b

Predictions performed using locally averaged features.