LICENSE
MANIFEST.in
README.md
setup.py
examples/MASTML_Tutorial_1_GettingStarted.ipynb
examples/MASTML_Tutorial_2_DataImport.ipynb
examples/MASTML_Tutorial_3_FeatureEngineering.ipynb
examples/MASTML_Tutorial_4_Models_and_Tests.ipynb
examples/MASTML_Tutorial_5_NestedCV_and_OptimizedModels.ipynb
examples/MASTML_Tutorial_6_ErrorAnalysis_UncertaintyQuantification.ipynb
examples/MASTML_Tutorial_7_ModelPredictions_with_Guide_Rails.ipynb
examples/developer/.DS_Store
examples/developer/containerization/MASTML_Tutorial_HostingModels.ipynb
examples/developer/containerization/diffusion.csv
examples/developer/containerization/cleaning_files/clean_docker.py
examples/developer/containerization/cleaning_files/clean_docker.sh
examples/developer/containerization/container_files/Dockerfile
examples/developer/containerization/container_files/predict.py
examples/developer/transfer_learning/make_sparse_uncorrelated/fit.py
examples/developer/transfer_learning/make_sparse_uncorrelated/run.sh
mastml/__init__.py
mastml/baseline_tests.py
mastml/data_cleaning.py
mastml/data_splitters.py
mastml/datasets.py
mastml/domain.py
mastml/error_analysis.py
mastml/feature_generators.py
mastml/feature_selectors.py
mastml/hyper_opt.py
mastml/learning_curve.py
mastml/mastml.py
mastml/mastml_predictor.py
mastml/metrics.py
mastml/models.py
mastml/plots.py
mastml/preprocessing.py
mastml.egg-info/PKG-INFO
mastml.egg-info/SOURCES.txt
mastml.egg-info/dependency_links.txt
mastml.egg-info/requires.txt
mastml.egg-info/top_level.txt
mastml/data/diffusion_data_allfeatures.xlsx
mastml/data/diffusion_data_leaveoutPt.xlsx
mastml/data/diffusion_data_nofeatures.xlsx
mastml/data/diffusion_data_selectfeatures.xlsx
mastml/magpie/AtomicNumber.table
mastml/magpie/AtomicRadii.table
mastml/magpie/AtomicVolume.table
mastml/magpie/AtomicWeight.table
mastml/magpie/BCCefflatcnt.table
mastml/magpie/BCCenergy_pa.table
mastml/magpie/BCCfermi.table
mastml/magpie/BCCmagmom.table
mastml/magpie/BCCvolume_pa.table
mastml/magpie/BCCvolume_padiff.table
mastml/magpie/BoilingT.table
mastml/magpie/BulkModulus.table
mastml/magpie/Column.table
mastml/magpie/CovalentRadii.table
mastml/magpie/CovalentRadius.table
mastml/magpie/Density.table
mastml/magpie/ElasticModulus.table
mastml/magpie/ElectricalConductivity.table
mastml/magpie/ElectronAffinity.table
mastml/magpie/Electronegativity.table
mastml/magpie/FirstIonizationEnergy.table
mastml/magpie/GSbandgap.table
mastml/magpie/GSenergy_pa.table
mastml/magpie/GSestBCClatcnt.table
mastml/magpie/GSestFCClatcnt.table
mastml/magpie/GSmagmom.table
mastml/magpie/GSvolume_pa.table
mastml/magpie/Group.table
mastml/magpie/HHIp.table
mastml/magpie/HHIr.table
mastml/magpie/HeatCapacityMass.table
mastml/magpie/HeatCapacityMolar.table
mastml/magpie/HeatFusion.table
mastml/magpie/HeatVaporization.table
mastml/magpie/ICSDVolume.table
mastml/magpie/IonicRadii.table
mastml/magpie/IonizationEnergy.table
mastml/magpie/IsAlkali.table
mastml/magpie/IsAlkalineEarth.table
mastml/magpie/IsBCC.table
mastml/magpie/IsBoron.table
mastml/magpie/IsCarbon.table
mastml/magpie/IsChalcogen.table
mastml/magpie/IsDBlock.table
mastml/magpie/IsFBlock.table
mastml/magpie/IsFCC.table
mastml/magpie/IsHalogen.table
mastml/magpie/IsHexagonal.table
mastml/magpie/IsMetal.table
mastml/magpie/IsMetalloid.table
mastml/magpie/IsMonoclinic.table
mastml/magpie/IsNobleGas.table
mastml/magpie/IsNonmetal.table
mastml/magpie/IsOrthorhombic.table
mastml/magpie/IsPnictide.table
mastml/magpie/IsRareEarth.table
mastml/magpie/IsRhombohedral.table
mastml/magpie/IsSimpleCubic.table
mastml/magpie/IsTetragonal.table
mastml/magpie/IsTransitionMetal.table
mastml/magpie/MeltingT.table
mastml/magpie/MendeleevNumber.table
mastml/magpie/MiracleRadius.table
mastml/magpie/NUnfilled.table
mastml/magpie/NValance.table
mastml/magpie/NdUnfilled.table
mastml/magpie/NdValence.table
mastml/magpie/NfUnfilled.table
mastml/magpie/NfValence.table
mastml/magpie/NpUnfilled.table
mastml/magpie/NpValence.table
mastml/magpie/NsUnfilled.table
mastml/magpie/NsValence.table
mastml/magpie/Number.table
mastml/magpie/OxidationStates.table
mastml/magpie/Period.table
mastml/magpie/Polarizability.table
mastml/magpie/Row.table
mastml/magpie/SecondIonizationEnergy.table
mastml/magpie/ShearModulus.table
mastml/magpie/SpaceGroupNumber.table
mastml/magpie/SpecificHeatCapacity.table
mastml/magpie/ThermalConductivity.table
mastml/magpie/ThermalExpansionCoefficient.table
mastml/magpie/ThirdIonizationEnergy.table
mastml/magpie/__init__.py
mastml/magpie/n_ws^third.table
mastml/magpie/phi.table
mastml/magpie/valence.table
mastml/tests/unit_tests/test_baseline_tests.py
mastml/tests/unit_tests/test_data_cleaning.py
mastml/tests/unit_tests/test_data_splitters.py
mastml/tests/unit_tests/test_data_splitters_parallel.py
mastml/tests/unit_tests/test_datasets.py
mastml/tests/unit_tests/test_feature_generators.py
mastml/tests/unit_tests/test_feature_selectors.py
mastml/tests/unit_tests/test_mastml.py
mastml/tests/unit_tests/test_metrics.py
mastml/tests/unit_tests/test_models.py
mastml/tests/unit_tests/test_plots.py
mastml/tests/unit_tests/test_preprocessing.py