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ML::ROCFunctions

This repository has the code of a Raku package for Receiver Operating Characteristic (ROC) functions.

The ROC framework is used for analysis and tuning of binary classifiers, [Wk1]. (The classifiers are assumed to classify into a positive/true label or a negative/false label. )

For computational introduction to ROC utilization (in Mathematica) see the article "Basic example of using ROC with Linear regression", [AA1].

This package has counterparts in Mathematica, Python, and R. See [AAp1, AAp2, AAp3].

The examples below use the packages "Data::Generators", "Data::Reshapers", and "Data::Summarizers", described in the article "Introduction to data wrangling with Raku", [AA2].


Installation

Via zef-ecosystem:

zef install ML::ROCFunctions

From GitHub:

zef install https://github.com/antononcube/Raku-ML-ROCFunctions

Usage examples

Properties

Here are some retrieval functions:

use ML::ROCFunctions; say roc-functions('properties');
# (FunctionInterpretations FunctionNames Functions Methods Properties) 
roc-functions('FunctionInterpretations')
# {ACC => accuracy, AUROC => area under the ROC curve, Accuracy => same as ACC, F1 => F1 score, FDR => false discovery rate, FNR => false negative rate, FOR => false omission rate, FPR => false positive rate, MCC => Matthews correlation coefficient, NPV => negative predictive value, PPV => positive predictive value, Precision => same as PPV, Recall => same as TPR, SPC => specificity, Sensitivity => same as TPR, TNR => true negative rate, TPR => true positive rate} 
say roc-functions('FPR');
# &FPR 

Single ROC record

Definition: A ROC record (ROC-hash or ROC-hash-map) is an object of type Associative that has the keys: "FalseNegative", "FalsePositive", "TrueNegative", "TruePositive". Here is an example:

{FalseNegative => 50, FalsePositive => 51, TrueNegative => 60, TruePositive => 39} 

Here we generate a random "dataset" with columns "Actual" and "Predicted" that have the values "true" and "false" and show the summary:

use Data::Generators; use Data::Summarizers; my @dfRandomLabels = random-tabular-dataset(200, <Actual Predicted>, generators => {Actual => <true false>, Predicted => <true false>}); records-summary(@dfRandomLabels)
# +--------------+--------------+ # | Actual | Predicted | # +--------------+--------------+ # | false => 107 | false => 102 | # | true => 93 | true => 98 | # +--------------+--------------+ 

Here is a sample of the dataset:

use Data::Reshapers; to-pretty-table(@dfRandomLabels.pick(6))
# +-----------+--------+ # | Predicted | Actual | # +-----------+--------+ # | false | true | # | true | false | # | false | true | # | false | true | # | true | false | # | false | false | # +-----------+--------+ 

Here we make the corresponding ROC hash-map:

to-roc-hash('true', 'false', @dfRandomLabels.map({$_<Actual>}), @dfRandomLabels.map({$_<Predicted>}))
# {FalseNegative => 49, FalsePositive => 54, TrueNegative => 53, TruePositive => 44} 

Multiple ROC records

Here we make random dataset with entries that associated with a certain threshold parameter with three unique values:

my @dfRandomLabels2 = random-tabular-dataset(200, <Threshold Actual Predicted>, generators => {Threshold => (0.2, 0.4, 0.6), Actual => <true false>, Predicted => <true false>}); records-summary(@dfRandomLabels2)
# +-----------------+--------------+--------------+ # | Threshold | Predicted | Actual | # +-----------------+--------------+--------------+ # | Min => 0.2 | true => 104 | false => 101 | # | 1st-Qu => 0.2 | false => 96 | true => 99 | # | Mean => 0.394 | | | # | Median => 0.4 | | | # | 3rd-Qu => 0.6 | | | # | Max => 0.6 | | | # +-----------------+--------------+--------------+ 

Remark: Threshold parameters are typically used while tuning Machine Learning (ML) classifiers.

Here we group the rows of the dataset by the unique threshold values:

my %groups = group-by(@dfRandomLabels2, 'Threshold'); records-summary(%groups)
# summary of 0.6 => # +-------------+---------------+-------------+ # | Predicted | Threshold | Actual | # +-------------+---------------+-------------+ # | true => 32 | Min => 0.6 | true => 32 | # | false => 25 | 1st-Qu => 0.6 | false => 25 | # | | Mean => 0.6 | | # | | Median => 0.6 | | # | | 3rd-Qu => 0.6 | | # | | Max => 0.6 | | # +-------------+---------------+-------------+ # summary of 0.4 => # +-------------+-------------+---------------+ # | Predicted | Actual | Threshold | # +-------------+-------------+---------------+ # | false => 41 | true => 41 | Min => 0.4 | # | true => 39 | false => 39 | 1st-Qu => 0.4 | # | | | Mean => 0.4 | # | | | Median => 0.4 | # | | | 3rd-Qu => 0.4 | # | | | Max => 0.4 | # +-------------+-------------+---------------+ # summary of 0.2 => # +---------------+-------------+-------------+ # | Threshold | Predicted | Actual | # +---------------+-------------+-------------+ # | Min => 0.2 | true => 33 | false => 37 | # | 1st-Qu => 0.2 | false => 30 | true => 26 | # | Mean => 0.2 | | | # | Median => 0.2 | | | # | 3rd-Qu => 0.2 | | | # | Max => 0.2 | | | # +---------------+-------------+-------------+ 

Here we find and print the ROC records (hash-maps) for each unique threshold value:

my @rocs = do for %groups.kv -> $k, $v { to-roc-hash('true', 'false', $v.map({$_<Actual>}), $v.map({$_<Predicted>})) } .say for @rocs;
# {FalseNegative => 16, FalsePositive => 16, TrueNegative => 9, TruePositive => 16} # {FalseNegative => 22, FalsePositive => 20, TrueNegative => 19, TruePositive => 19} # {FalseNegative => 13, FalsePositive => 20, TrueNegative => 17, TruePositive => 13} 

Application of ROC functions

Here we define a list of ROC functions:

my @funcs = (&PPV, &NPV, &TPR, &ACC, &SPC, &MCC);
# [&PPV &NPV &TPR &ACC &SPC &MCC] 

Here we apply each ROC function to each of the ROC records obtained above:

my @rocRes = @rocs.map( -> $r { @funcs.map({ $_.name => $_($r) }).Hash }); say to-pretty-table(@rocRes);
# +----------+----------+-----------+----------+----------+----------+ # | ACC | SPC | MCC | TPR | PPV | NPV | # +----------+----------+-----------+----------+----------+----------+ # | 0.438596 | 0.360000 | -0.141393 | 0.500000 | 0.500000 | 0.360000 | # | 0.475000 | 0.487179 | -0.049420 | 0.463415 | 0.487179 | 0.463415 | # | 0.476190 | 0.459459 | -0.040574 | 0.500000 | 0.393939 | 0.566667 | # +----------+----------+-----------+----------+----------+----------+ 

References

Articles

[Wk1] Wikipedia entry, "Receiver operating characteristic".

[AA1] Anton Antonov, "Basic example of using ROC with Linear regression", (2016), MathematicaForPrediction at WordPress.

[AA2] Anton Antonov, "Introduction to data wrangling with Raku", (2021), RakuForPrediction at WordPress.

Packages

[AAp0] Anton Antonov, ML::ROCFunctions Raku package, (2022), GitHub/antononcube.

[AAp1] Anton Antonov, ROCFunctions Mathematica package, (2016-2022), MathematicaForPrediction at GitHub/antononcube.

[AAp2] Anton Antonov, ROCFunctions Python package, (2022), Python-packages at GitHub/antononcube.

[AAp3] Anton Antonov, ROCFunctions R package, (2021), R-packages at GitHub/antononcube.

[AAp4] Anton Antonov, Data::Generators Raku package, (2021), GitHub/antononcube.

[AAp5] Anton Antonov, Data::Reshapers Raku package, (2021), GitHub/antononcube.

[AAp6] Anton Antonov, Data::Summarizers Raku package, (2021), GitHub/antononcube.

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Raku package for Receiver Operating Characteristic (ROC) functions.

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