Index

A

adaboost_regressor() (in module amlro.ml_models) amlro module amlro.const module amlro.generate_reaction_conditions module amlro.generate_training_data module

amlro.ml_models module amlro.optimizer module amlro.pareto module amlro.sampling_methods module amlro.validations module

B

bayesian_ridge_regressor() (in module amlro.ml_models)

C

calculate_frontier_depth() (in module amlro.pareto)

categorical_feature_decoding() (in module amlro.optimizer) categorical_feature_encoding() (in module amlro.optimizer)

D

decision_tree_regressor() (in module amlro.ml_models)

E

elastic_net_regressor() (in module amlro.ml_models)

F

feature_scaling() (in module amlro.sampling_methods)

G

generate_reaction_grid() (in module amlro.generate_reaction_conditions) generate_training_data() (in module amlro.generate_training_data) get_next_training_conditions() (in module amlro.generate_training_data) get_optimized_parameters() (in module amlro.optimizer)

get_ranked_pareto_fronts() (in module amlro.pareto) get_reaction_scope() (in module amlro.generate_reaction_conditions) get_regressor_model() (in module amlro.ml_models) gradient_boost_regressor() (in module amlro.ml_models)

I

identify_pareto_front() (in module amlro.pareto)

is_dominated_by_any() (in module amlro.pareto) is_pareto_dominant() (in module amlro.pareto)

K

knn_regressor() (in module amlro.ml_models)

L

latin_hypercube_sampling() (in module amlro.sampling_methods)

load_data() (in module amlro.optimizer) load_training_conditions() (in module amlro.generate_training_data)

M

mo_model_training() (in module amlro.optimizer) model_training() (in module amlro.optimizer) module amlro amlro.const amlro.generate_reaction_conditions amlro.generate_training_data amlro.ml_models amlro.optimizer amlro.pareto amlro.sampling_methods amlro.validations

P

predict_next_parameters() (in module amlro.optimizer)

R

random_forest_regressor() (in module amlro.ml_models)

random_sampling() (in module amlro.sampling_methods)

S

select_batch_from_ranked_fronts() (in module amlro.pareto) sobol_sequnce_sampling() (in module amlro.sampling_methods)

stringify_parameters_objectives() (in module amlro.optimizer) support_vector_regressor() (in module amlro.ml_models)

V

validate_optimizer_config() (in module amlro.validations)

validate_reaction_scope_config() (in module amlro.validations)

W

write_data_to_training() (in module amlro.optimizer) write_data_to_training_files() (in module amlro.generate_training_data)

write_line_to_a_file() (in module amlro.generate_training_data) write_reaction_scope() (in module amlro.generate_reaction_conditions) write_training_data() (in module amlro.generate_training_data)

X

xgboost_regressor() (in module amlro.ml_models)