Files in jrash/chemmodlab
A Cheminformatics Modeling Laboratory for Fitting and Assessing Machine Learning Models
.Rbuildignore
.gitattributes
.gitignore
.travis.yml
DESCRIPTION
LICENSE
NAMESPACE
NEWS.md
R/accum_curve.R
R/aid364.R
R/applicability_domain.R
R/confidence_bands.r
R/data.R
R/hit_enrich_curve.R
R/hypothesis_test.r
R/mcs_plot.R
R/model_assess.R
R/model_train.R
R/model_train_generic.R
R/model_train_utilities.R
R/models.R
R/output_progress.R
R/performance_measures.R
R/plot_results.R
R/read_in_data.R
R/set_model_params.R
README-unnamed-chunk-3-1.png
README-unnamed-chunk-4-1.png
README-unnamed-chunk-5-1.png
README-unnamed-chunk-6-1.png
README-unnamed-chunk-6-2.png
README-unnamed-chunk-6-3.png
README-unnamed-chunk-6-4.png
README-unnamed-chunk-6-5.png
README.Rmd
README.md
chemmodlab.Rproj
cran-comments.md
data-raw/AID_364_response.csv
data-raw/BurdenNumbers.csv
data-raw/Pharmacophores.csv
data-raw/aid364.R
data-raw/pparg.R
data-raw/pparg.csv
data/aid364.rda
data/pparg.rda
man/ApplicabilityDomain.Rd
man/CombineSplits.Rd
man/HitEnrich.Rd
man/HitEnrichDiff.Rd
man/MakeModelDefaults.Rd
man/ModelTrain.Rd
man/PerfCurveBands.Rd
man/PerfCurveTest.Rd
man/aid364.Rd
man/chemmodlab.Rd
man/plot.chemmodlab.Rd
man/pparg.Rd
