synplan package#
Subpackages#
- synplan.chem package
- synplan.interfaces package
- synplan.mcts package
- synplan.ml package
- synplan.route_quality package
CompetingInteractionCompetingSitesScoreFunctionalGroupDetectorFunctionalGroupMatchHalogenDetectorHalogenMatchIncompatibilityMatrixProtectionConfigProtectionRouteScorerRouteScannerRouteScorerclassify_reaction_type()classify_reaction_type_broad()classify_reaction_type_detailed()get_reaction_center_atoms()- synplan.route_quality.protection package
- synplan.utils package
- Submodules
- synplan.utils.config module
BaseConfigModelCombinedPolicyConfigPolicyEvaluationConfigPolicyNetworkConfigPolicyNetworkConfig.attn_dropoutPolicyNetworkConfig.attn_typePolicyNetworkConfig.batch_sizePolicyNetworkConfig.dropoutPolicyNetworkConfig.embedder_typePolicyNetworkConfig.headsPolicyNetworkConfig.learning_ratePolicyNetworkConfig.log_grad_normPolicyNetworkConfig.loggerPolicyNetworkConfig.model_configPolicyNetworkConfig.num_conv_layersPolicyNetworkConfig.num_epochPolicyNetworkConfig.policy_typePolicyNetworkConfig.priority_rules_fractionPolicyNetworkConfig.rule_prob_thresholdPolicyNetworkConfig.top_rulesPolicyNetworkConfig.trainerPolicyNetworkConfig.vector_dimPolicyNetworkConfig.weights_path
RDKitEvaluationConfigRandomEvaluationConfigReactorConfigRolloutEvaluationConfigRuleExtractionConfigRuleExtractionConfig.as_query_containerRuleExtractionConfig.atom_info_retentionRuleExtractionConfig.environment_atom_countRuleExtractionConfig.func_groups_listRuleExtractionConfig.include_func_groupsRuleExtractionConfig.include_ringsRuleExtractionConfig.keep_incoming_groupsRuleExtractionConfig.keep_leaving_groupsRuleExtractionConfig.keep_metadataRuleExtractionConfig.keep_reagentsRuleExtractionConfig.min_popularityRuleExtractionConfig.model_configRuleExtractionConfig.multicenter_rulesRuleExtractionConfig.reactor_validationRuleExtractionConfig.reverse_ruleRuleExtractionConfig.single_product_only
TreeConfigTreeConfig.algorithmTreeConfig.backprop_typeTreeConfig.beam_widthTreeConfig.c_ucbTreeConfig.enable_pruningTreeConfig.epsilonTreeConfig.evaluation_aggTreeConfig.exclude_smallTreeConfig.init_node_valueTreeConfig.lnmcs_ratioTreeConfig.max_depthTreeConfig.max_iterationsTreeConfig.max_rules_appliedTreeConfig.max_timeTreeConfig.max_tree_sizeTreeConfig.min_mol_sizeTreeConfig.model_configTreeConfig.nmcs_levelTreeConfig.nmcs_playout_modeTreeConfig.normalize_scoresTreeConfig.search_strategyTreeConfig.silentTreeConfig.stop_at_firstTreeConfig.ucb_type
TuningConfigValueNetworkConfigValueNetworkEvaluationConfig
- synplan.utils.files module
FileHandlerMoleculeReaderMoleculeWriterRawReactionReaderReactionReaderReactionWriterReaderSMILESReadWritercount_rdf_records()count_sdf_records()count_smiles_records()init_parse_worker()iter_csv_smiles()iter_csv_smiles_blocks()iter_rdf_text_blocks()iter_sdf_text_blocks()iter_smiles()iter_smiles_blocks()load_rule_index_mapping_tsv()open_text()parse_one()parse_reaction()to_reaction_smiles_record()
- synplan.utils.loading module
- synplan.utils.logging module
- synplan.utils.visualisation module
- Module contents