Last updated: 2019-08-13

Checks: 6 1

Knit directory: polymeRID/

This reproducible R Markdown analysis was created with workflowr (version 1.4.0.9001). The Checks tab describes the reproducibility checks that were applied when the results were created. The Past versions tab lists the development history.


The R Markdown is untracked by Git. To know which version of the R Markdown file created these results, you’ll want to first commit it to the Git repo. If you’re still working on the analysis, you can ignore this warning. When you’re finished, you can run wflow_publish to commit the R Markdown file and build the HTML.

Great job! The global environment was empty. Objects defined in the global environment can affect the analysis in your R Markdown file in unknown ways. For reproduciblity it’s best to always run the code in an empty environment.

The command set.seed(20190729) was run prior to running the code in the R Markdown file. Setting a seed ensures that any results that rely on randomness, e.g. subsampling or permutations, are reproducible.

Great job! Recording the operating system, R version, and package versions is critical for reproducibility.

Nice! There were no cached chunks for this analysis, so you can be confident that you successfully produced the results during this run.

Great job! Using relative paths to the files within your workflowr project makes it easier to run your code on other machines.

Great! You are using Git for version control. Tracking code development and connecting the code version to the results is critical for reproducibility. The version displayed above was the version of the Git repository at the time these results were generated.

Note that you need to be careful to ensure that all relevant files for the analysis have been committed to Git prior to generating the results (you can use wflow_publish or wflow_git_commit). workflowr only checks the R Markdown file, but you know if there are other scripts or data files that it depends on. Below is the status of the Git repository when the results were generated:


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    Modified:   ref/wavenumbers.rds

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There are no past versions. Publish this analysis with wflow_publish() to start tracking its development.


The idea of the exploration stage is to find an optimal configuration between the hyper-parameters of the machine learning algorithms and different representations of the input data. On the one hand, algorithms such as support-vector-machines (SVM), random forest (RF) and convolutional neural networks (CNN), need proper fine-tuning of their parameters to effectively learn the patterns we are interested in. On the other hand, it is possible to present the data in different forms to the algorithms, each representing different “ways” to look at the samples. The main goal of such an exploration is to optimize the outcome of the training process, bearing in mind that such a process is basically a function of desired accuracy, computational costs, and data availability.

Here, all three previously mentioned machine learning algorithms, SVM, RF, and, CNN were tested for their ability to classify plastic polymers based on their spectral reflectance data measured by a FTIR spectrometer. Consequently, the workflow and the results are presented individually for the different algorithms.


sessionInfo()
R version 3.6.1 (2019-07-05)
Platform: x86_64-pc-linux-gnu (64-bit)
Running under: Linux Mint 19.1

Matrix products: default
BLAS:   /usr/lib/x86_64-linux-gnu/blas/libblas.so.3.7.1
LAPACK: /usr/lib/x86_64-linux-gnu/lapack/liblapack.so.3.7.1

locale:
 [1] LC_CTYPE=en_US.UTF-8       LC_NUMERIC=C              
 [3] LC_TIME=en_US.UTF-8        LC_COLLATE=en_US.UTF-8    
 [5] LC_MONETARY=de_DE.UTF-8    LC_MESSAGES=en_US.UTF-8   
 [7] LC_PAPER=de_DE.UTF-8       LC_NAME=C                 
 [9] LC_ADDRESS=C               LC_TELEPHONE=C            
[11] LC_MEASUREMENT=de_DE.UTF-8 LC_IDENTIFICATION=C       

attached base packages:
[1] stats     graphics  grDevices utils     datasets  methods   base     

other attached packages:
 [1] plotly_4.9.0              tensorflow_1.14.0        
 [3] abind_1.4-5               e1071_1.7-2              
 [5] keras_2.2.4.1             workflowr_1.4.0.9001     
 [7] baseline_1.2-1            gridExtra_2.3            
 [9] stringr_1.4.0             prospectr_0.1.3          
[11] RcppArmadillo_0.9.600.4.0 openxlsx_4.1.0.1         
[13] magrittr_1.5              ggplot2_3.2.0            
[15] reshape2_1.4.3            dplyr_0.8.3              

loaded via a namespace (and not attached):
 [1] reticulate_1.13   tidyselect_0.2.5  xfun_0.8         
 [4] purrr_0.3.2       lattice_0.20-38   colorspace_1.4-1 
 [7] generics_0.0.2    viridisLite_0.3.0 htmltools_0.3.6  
[10] yaml_2.2.0        base64enc_0.1-3   rlang_0.4.0      
[13] pillar_1.4.2      glue_1.3.1        withr_2.1.2      
[16] foreach_1.4.7     plyr_1.8.4        munsell_0.5.0    
[19] gtable_0.3.0      zip_2.0.3         htmlwidgets_1.3  
[22] codetools_0.2-16  evaluate_0.14     knitr_1.24       
[25] SparseM_1.77      tfruns_1.4        class_7.3-15     
[28] Rcpp_1.0.2        scales_1.0.0      backports_1.1.4  
[31] jsonlite_1.6      fs_1.3.1          digest_0.6.20    
[34] stringi_1.4.3     grid_3.6.1        rprojroot_1.3-2  
[37] tools_3.6.1       lazyeval_0.2.2    tibble_2.1.3     
[40] tidyr_0.8.3       crayon_1.3.4      whisker_0.3-2    
[43] pkgconfig_2.0.2   zeallot_0.1.0     Matrix_1.2-17    
[46] data.table_1.12.2 httr_1.4.1        assertthat_0.2.1 
[49] rmarkdown_1.14    iterators_1.0.12  R6_2.4.0         
[52] git2r_0.26.1      compiler_3.6.1