SynKit
Toolkit for synthesis planning
File Explorer
- conda-forge-publish.yml
- docker-publish.yml
- publish-package.yml
- test-and-lint.yml
- dependabot.yml
- __init__.py
- vis.py
- canon_graph_time.py
- canon_rsmi_time.py
- benchmarking_clustering.py
- __init__.py
- io_convert.py
- __init__.py
- benchmark_subgraph.py
- case_study.ipynb
- data_aam.json.gz
- experiments.ipynb
- rdchiral.ipynb
- run_benchmarks.sh
- stereomolgraph_graph_conformance.json
- synkit.png
- synkit_graphical_abstract.svg
- M00001_abstract.json
- M00001_imputed.json
- M00001_raw.json
- attribute_propagation_v1_5.json
- 00_species_lookup.json
- 01_rule_table.json
- 02_canonicalization.json
- 03_stoich_summary.json
- 04_path_H_qualitative.json
- 05_path_J_qualitative.json
- 06_path_H_validated.json
- 07_path_J_validated.json
- 08_realizability_H.json
- 09_initial_marking_sensitivity.json
- 10_trace_H.json
- 11_trace_J.json
- 12_petri_summary.json
- 13_final_summary.json
- 14_thermo_summary.json
- 15_dynamics_jacobian_sparsity.json
- 16_dynamics_jacobian_sign_pattern.json
- 17_species_influence_graph.json
- 18_structural_singularity_summary.json
- 00_syn_description.txt
- 01_equations_label.txt
- 02_equations_smiles.txt
- 03_path_H_qualitative.txt
- 04_path_J_qualitative.txt
- 05_path_H_validated.txt
- 06_path_J_validated.txt
- 07_trace_H.txt
- 08_trace_J.txt
- 09_subnetwork_H_description.txt
- 10_subnetwork_H_label.txt
- 11_subnetwork_H_smiles.txt
- 12_subnetwork_J_description.txt
- 13_subnetwork_J_label.txt
- 14_subnetwork_J_smiles.txt
- 15_petri_explain.txt
- 16_thermo_summary.txt
- 17_structural_singularity_summary.txt
- glycolysis.log
- hsa00010_abstract.json
- hsa00010_imputed.json
- hsa00010_raw.json
- label_to_name_smiles.json
- __init__.py
- formose.py
- glycolysis.py
- glycolysis_data.py
- __init__.py
- data.txt
- 0.gml
- 1.gml
- 2.gml
- hydrogen_test.pkl.gz
- graph.pkl.gz
- mech.json.gz
- para_rule.json.gz
- para_rule_retro.json.gz
- test.pkl.gz
- ecoli.json.gz
- smart.json.gz
- custom.css
- favicon.svg
- logo-dark.svg
- logo.svg
- sidebar-globaltoc.html
- chem.rst
- crn.rst
- graph.rst
- index.rst
- io.rst
- rule.rst
- synthesis.rst
- vis.rst
- aldol.png
- aldol_its.png
- context.png
- epd_sn2.png
- mtg.png
- mtg_lsg_changed_core.png
- mtg_mechanism.png
- vis_lsg_sn2.png
- vis_molecule_aspirin.png
- vis_mtg_steps.png
- vis_mtg_timeline.png
- vis_reaction_sn2.png
- changelog.rst
- chem.rst
- conf.py
- crn.rst
- getting_started.rst
- graph.rst
- index.rst
- io.rst
- reference.rst
- refs.bib
- requirements.txt
- rule.rst
- stereo_reactions.rst
- synthesis.rst
- vis.rst
- __init__.py
- biomodels.py
- common.py
- formose_case_study.py
- kegg_case_study.py
- paper_assets.py
- README.md
- refresh_kegg_cache.py
- run_all.py
- scaling.py
- validation.py
- PMechDB-DATA-NOTICE.md
- RMechDB-DATA-NOTICE.md
- all.csv
- benchmark.json.gz
- combinatorial_all.csv
- hydrogen.pkl.gz
- README.md
- batch-01-of-10.txt.gz
- batch-02-of-10.txt.gz
- batch-03-of-10.txt.gz
- batch-04-of-10.txt.gz
- batch-05-of-10.txt.gz
- batch-06-of-10.txt.gz
- batch-07-of-10.txt.gz
- batch-08-of-10.txt.gz
- batch-09-of-10.txt.gz
- batch-10-of-10.txt.gz
- manifest.json
- bugs.jsonl
- __init__.py
- combine_mechanisms.py
- consolidate_f2.py
- prepare_batches.py
- prepare_failure_rows.py
- prepare_failure_shards.py
- prepare_resume.py
- README.md
- replay.py
- run_bidirectional_replay.sh
- shard_row_sets.py
- __init__.py
- benchmark.py
- gmapache_worker.py
- README.md
- reference_methods.py
- run_comparison.sh
- mechanismbench_evidence.json
- electrocyclic_machinery.json
- polar.json
- radical.json
- README.md
- stereo.json
- stereo_branch_coverage.json
- stereo_couplings.json
- polar-failures.csv
- radical-arrow-review.csv
- radical-failures.csv
- README.md
- __init__.py
- audit.py
- evidence.py
- README.md
- README.md
- __init__.py
- benchmark.py
- plot.py
- repeat_external.py
- repeat_synkit.py
- run_runtime_metadata.sh
- timing_artifacts.py
- results.json
- tuple-cases.jsonl.gz
- typesGH-cases.jsonl.gz
- known-records-tuple-60s-cases.jsonl.gz
- known-records-typesGH-60s-cases.jsonl.gz
- record-12272-tuple-300s-cases.jsonl.gz
- record-12272-typesGH-300s-cases.jsonl.gz
- results.json
- tuple-cases.jsonl.gz
- typesGH-cases.jsonl.gz
- graph-rewriting-comparison.png
- README.md
- __init__.py
- benchmark.py
- mod_benchmark.py
- plot.py
- __init__.py
- common.py
- README.md
- run_experiments.sh
- __init__.py
- paper_assets.py
- README.md
- validation.py
- __init__.py
- benchmark.py
- build_dataset.py
- classify_complete_retry.py
- exhaustive_overlap_oracle.py
- partition_results.py
- README.md
- retry_complete.py
- scan_fast_track.py
- scan_verified_mcs.py
- validate_dataset.py
- __init__.py
- atom_relabel.py
- configuration_free_global.py
- configuration_free_local.py
- global_local.py
- inventory.py
- local_permutations.py
- multi_element.py
- README.md
- rota_local.py
- run.py
- __init__.py
- draw_exact_mismatch_figure.py
- exact_mirror.py
- global_certificate_benchmark.py
- global_stereo_performance.py
- published.py
- README.md
- relations.py
- run.py
- vs300_diagnostic.py
- ci5c02523_si_002.csv
- ci5c02523_si_002.metadata.json
- LICENSE.md
- README.md
- global_formal_canonicalization_report.json
- global_formal_canonicalization_table.csv
- global_raw_canonicalization_report.json
- global_raw_canonicalization_table.csv
- global_formal_canonicalization_report.json
- global_formal_canonicalization_table.csv
- global_raw_canonicalization_report.json
- global_raw_canonicalization_table.csv
- global_formal_canonicalization_report.json
- global_formal_canonicalization_table.csv
- global_raw_vs146_canonicalization_report.json
- global_raw_vs146_canonicalization_table.csv
- acs_local_canonicalization_report.json
- acs_local_canonicalization_table.csv
- canonicalization_inventory.csv
- canonicalization_inventory.json
- cip_local_canonicalization_report.json
- cip_local_canonicalization_table.csv
- global_local_canonicalization_report.json
- internal_local_canonicalization_report.json
- internal_local_canonicalization_table.csv
- multi_element_canonicalization_report.json
- README.md
- rota_local_canonicalization_report.json
- rota_local_canonicalization_table.csv
- LICENSE
- metadata.json
- README.md
- RotA.xlsx
- exact_acs_mirror_report.json
- published_acs_chirality_report.json
- stereoisomer_relation_report.json
- input_contract_audit.json
- metadata.json
- README.md
- benchmark_report.json
- cip_native_report.json
- full_detection_report.json
- perception_conformance_cases.json
- perception_conformance_report.json
- README.md
- rota_locus_report.json
- stereo_element_report.json
- negative_axes.json
- BACKEND_DISAGREEMENT_REVIEW.md
- manifest.json
- README.md
- __init__.py
- backend_comparison.py
- stereomolgraph_conformance.py
- __init__.py
- axis_loci.py
- cip_input_contract.py
- cip_labels.py
- conformance.py
- family_executors.py
- full_detection.py
- README.md
- rota_synthetic_negatives.py
- stereo_elements.py
- __init__.py
- benchmark.sh
- datasets.py
- README.md
- README.md
- validation.py
- workflows.py
- __init__.py
- README.md
- meta.yaml
- __init__.py
- build_doc.sh
- check_docstring_style.py
- check_package_artifacts.py
- check_python_file_size.py
- lint.sh
- pytest.sh
- python_file_size_baseline.json
- README.md
- __init__.py
- butina.py
- __init__.py
- fp_calculator.py
- smiles_featurizer.py
- transformation_fp.py
- __init__.py
- _chirality_loci.py
- _chirality_types.py
- _helical_loci.py
- _stereo_axis_evidence.py
- _stereo_element_detection.py
- _stereo_orientation_constraints.py
- _tetrahedral_carriers.py
- atom_features.py
- chirality.py
- cip_assignment.py
- cip_ranking.py
- coordinate_stereo.py
- derived_stereo_naming.py
- descriptors.py
- formula.py
- global_stereo.py
- graph_annotator.py
- standardize.py
- stereo_evidence.py
- stereo_perception.py
- valence.py
- __init__.py
- aam.py
- its.py
- smiles.py
- __init__.py
- branching.py
- certificate.py
- enumerate.py
- enumeration_result.py
- exhaustive.py
- kernel.py
- milp.py
- __init__.py
- automorphism.py
- blockcut.py
- labeled_graph.py
- refine.py
- synkit_adapter.py
- __init__.py
- idxmapstr.py
- __init__.py
- lap.py
- sequential.py
- __init__.py
- aam_validator.py
- __init__.py
- aam_validator.py
- balance_check.py
- canon_rsmi.py
- cleaning.py
- deionize.py
- explicit_h_audit.py
- fix_aam.py
- neutralize.py
- radical_wildcard.py
- standardize.py
- tautomerize.py
- __init__.py
- utils.py
- kegg_modules.json
- __init__.py
- crosschecks.py
- kegg.py
- networks.py
- scaling.py
- validate.py
- __init__.py
- abstract.py
- arity.py
- builder.py
- derivation.py
- flattener.py
- keys.py
- mixtures.py
- smiles.py
- state.py
- strategy.py
- worker.py
- __init__.py
- sbml.py
- __init__.py
- _adapter.py
- pathfinder.py
- reachability.py
- realizability.py
- __init__.py
- analyzer.py
- minimal_semiflows.py
- net.py
- persistence.py
- semiflows.py
- siphon_search.py
- structure.py
- __init__.py
- deficiency.py
- dynamics.py
- helper.py
- stoich.py
- thermo.py
- __init__.py
- kegg_api.py
- kegg_extract.py
- kegg_impute.py
- kegg_parse.py
- to_syncrn.py
- __init__.py
- _graph_io.py
- _matrices.py
- _parse.py
- reaction.py
- rule.py
- species.py
- syncrn.py
- __init__.py
- _common.py
- _ir.py
- automorphism.py
- canon.py
- isomorphism.py
- symmetry.py
- wl_canon.py
- __init__.py
- labels.py
- layout.py
- palette.py
- validation.py
- vis.py
- __init__.py
- kinds.py
- __init__.py
- aldol.json.gz
- gen_partial_aam.py
- paracetamol.json.gz
- __init__.py
- canon_algs.py
- canon_graph.py
- exact.py
- exact_refinement.py
- nauty.py
- __init__.py
- hier_context.py
- radius_expand.py
- topology.py
- __init__.py
- wl_rxn_fps.py
- __init__.py
- graph_descriptors.py
- graph_fps.py
- graph_signature.py
- hash_fps.py
- morgan_fps.py
- path_fps.py
- wl_hash.py
- __init__.py
- api.py
- audit.py
- catalog.py
- detector.py
- model.py
- recognizers.py
- ring_system.py
- __init__.py
- candidate.py
- constructor.py
- identity.py
- interface.py
- search.py
- __init__.py
- _misc.py
- hcomplete.py
- hcomplete_legacy.py
- hcompletion_algorithms.py
- hextend.py
- hextend_legacy.py
- __init__.py
- its_builder.py
- its_construction.py
- its_decompose.py
- its_destruction.py
- its_expand.py
- its_relabel.py
- its_reverter.py
- normalize_aam.py
- partial_its.py
- rc_extractor.py
- stereo.py
- __init__.py
- approx_mcs.py
- auto_est.py
- automorphism.py
- batch_cluster.py
- dedup_matches.py
- graph_cluster.py
- graph_matcher.py
- graph_morphism.py
- mcs_matcher.py
- multi_turbo_iso.py
- orbit.py
- partial_matcher.py
- sing.py
- subgraph_matcher.py
- turbo_iso.py
- wl_sel.py
- __init__.py
- conversion.py
- conversion_debug.py
- electron_accounting.py
- lwg_editor.py
- lwg_ops.py
- __init__.py
- constraints.py
- llg.py
- morphism.py
- stereo.py
- stereo_morphism.py
- stereo_morphism_helpers.py
- stereo_morphism_types.py
- __init__.py
- history.py
- mcs_matcher.py
- mtg.py
- mtg_explore.py
- process.py
- series_parallel.py
- utils.py
- __init__.py
- _descriptor_core.py
- _descriptor_serialization.py
- canonical.py
- changes.py
- composition.py
- configured.py
- couplings.py
- descriptors.py
- enumeration.py
- extended_descriptors.py
- global_configured.py
- global_stereo.py
- identity.py
- interchange.py
- legacy.py
- matching.py
- orbits.py
- outcomes.py
- pairwise.py
- rdkit_adapter.py
- reaction_interchange.py
- semantics.py
- supports.py
- wire.py
- __init__.py
- fuse_graph.py
- graph_wc.py
- its_merge.py
- radwc.py
- wc_matcher.py
- wildcard.py
- __init__.py
- canon_graph.py
- syn_graph.py
- utils.py
- __init__.py
- gml_to_graph.py
- graph_to_gml.py
- graph_to_smarts.py
- smarts_expander.py
- smarts_generalizer.py
- smarts_to_graph.py
- __init__.py
- chem_converter.py
- conversion.py
- data_io.py
- data_process.py
- debug.py
- gml_to_nx.py
- graph_to_mol.py
- mol_to_graph.py
- mol_to_graph_chemistry.py
- nx_to_gml.py
- smiles_to_id.py
- __init__.py
- adapters.py
- audit.py
- benchmark.py
- compatibility.py
- drawing.py
- electron_models.py
- equivalence.py
- evidence.py
- interchange.py
- model.py
- neighbor_stereo.py
- radical_data.py
- replay.py
- schema.py
- stereo_state.py
- symbols.py
- __init__.py
- dpo.py
- rule_matcher.py
- __init__.py
- _identity.py
- composition.py
- laws.py
- search.py
- synrule.py
- __init__.py
- implict_rule.py
- longest_path.py
- molecule_rule.py
- prune_templates.py
- rule_utils.py
- strip_rule.py
- __init__.py
- generic_stereo.py
- stereo_identity.py
- syn_rule.py
- __init__.py
- _base.py
- _plot.py
- _ranking.py
- __init__.py
- path_finder.py
- __init__.py
- engine.py
- matching.py
- overlap.py
- pipeline.py
- policy.py
- proof.py
- reaction.py
- state.py
- validation.py
- __init__.py
- engine.py
- product.py
- rewrite.py
- strategy.py
- __init__.py
- mixin.py
- policy.py
- symmetry.py
- __init__.py
- deduplication.py
- policy.py
- serialization.py
- structural.py
- __init__.py
- assignment.py
- mixin.py
- __init__.py
- imbalanced.py
- partial.py
- __init__.py
- batch.py
- benchmark.py
- postprocess.py
- rule_filter.py
- __init__.py
- __init__.py
- reactor_utils.py
- __init__.py
- utils.py
- __init__.py
- __init__.py
- arrows.py
- chem.py
- constants.py
- layout.py
- mapping.py
- models.py
- render.py
- utils.py
- visualizer.py
- __init__.py
- drawer.py
- __init__.py
- drawer.py
- reaction.py
- __init__.py
- drawer.py
- __init__.py
- rule.py
- rxn.py
- __init__.py
- chemical.py
- embedding.py
- __init__.py
- dpo.py
- rxn_vis.py
- vis.py
- __init__.py
- graph_visualizer.py
- its_drawer.py
- molecule_drawer.py
- mtg_drawer.py
- pdf_writer.py
- reaction_drawer.py
- visual_drawer.py
- visual_model.py
- __init__.py
- examples.py
- version.py
- test_experiment_layout.py
- test_flower_batches.py
- test_flower_combination.py
- test_flower_replay_invariants.py
- test_hydrogen_expand.py
- test_minimal_lwg_replay.py
- test_mod_rule_replay.py
- test_partial_expand_runtime.py
- test_relative_lone_pair_replay.py
- test_benchmark.py
- test_build_dataset.py
- __init__.py
- test_atom_relabel.py
- test_configuration_free_global.py
- test_configuration_free_local.py
- test_global_local.py
- test_inventory.py
- test_multi_element.py
- test_rota_local.py
- __init__.py
- test_global_certificate_benchmark.py
- test_vs300_diagnostic.py
- __init__.py
- test_cip_coordinate.py
- test_cip_input_contract.py
- test_conformance_data.py
- test_full_detection.py
- test_rota_synthetic_negatives.py
- conftest.py
- test_cip_native_benchmark.py
- test_stereo_dataset_registry.py
- test_stereo_element_benchmark.py
- test_mtg_paper_assets.py
- test_mtg_validation.py
- test_stereo_rxn_validation.py
- __init__.py
- test_fp_calculator.py
- test_smiles_featurizer.py
- test_transformation_fp.py
- __init__.py
- test_atom_features.py
- test_cip_assignment.py
- test_cip_ranking.py
- test_coordinate_stereo.py
- test_derived_stereo_naming.py
- test_descriptors.py
- test_extended_stereo_integration.py
- test_formula.py
- test_graph_annotator.py
- test_molecular_chirality.py
- test_molecular_chirality_assessment.py
- test_standardize.py
- test_stereo_perception.py
- test_valence.py
- conftest.py
- test_chem_aam.py
- test_chem_its.py
- test_chem_package.py
- test_chem_smiles.py
- test_exact_branching.py
- test_exact_certificate.py
- test_exact_enumerate.py
- test_exact_exhaustive.py
- test_exact_kernel.py
- test_exact_milp.py
- test_exact_package.py
- test_graph_automorphism.py
- test_graph_blockcut.py
- test_graph_labeled_graph.py
- test_graph_package.py
- test_graph_refine.py
- test_graph_synkit_adapter.py
- test_io_idxmapstr.py
- test_io_package.py
- test_mapper_aam_validator.py
- test_mapper_package.py
- test_slap_lap.py
- test_slap_package.py
- test_slap_sequential.py
- __init__.py
- test_aam_validator.py
- test_balance_checker.py
- test_canon_rsmi.py
- test_cleanning.py
- test_deionize.py
- test_explicit_h_audit.py
- test_fix_aam.py
- test_neutralize.py
- test_public_api.py
- test_radical_wildcard.py
- test_standardize.py
- test_tautomerize.py
- __init__.py
- test_utils.py
- __init__.py
- test_kegg_case_study.py
- test_scaling.py
- test_validation.py
- __init__.py
- _case.py
- test_abstract.py
- test_arity.py
- test_builder.py
- test_delta.py
- test_derivation.py
- test_flattener.py
- test_keys.py
- test_mixtures.py
- test_smiles.py
- test_state.py
- test_strategy.py
- test_worker.py
- __init__.py
- test_sbml.py
- __init__.py
- test_adapter.py
- test_pathway_finder.py
- test_reachability.py
- test_realizability.py
- __init__.py
- test_analyzer.py
- test_minimal_semiflows.py
- test_net.py
- test_persistence.py
- test_semiflows.py
- test_siphon_search.py
- test_structure.py
- __init__.py
- test_conservation.py
- test_deficiency.py
- test_dynamics.py
- test_helpers.py
- test_stoich.py
- test_thermo.py
- test_utils.py
- __init__.py
- test__kegg_extract.py
- test_kegg_api.py
- test_kegg_impute.py
- test_kegg_parse.py
- __init__.py
- test_reaction.py
- test_rule.py
- test_species.py
- test_syncrn.py
- __init__.py
- test_automorphism.py
- test_canon.py
- test_ir.py
- test_isomorphism.py
- test_symmetry.py
- __init__.py
- test_labels.py
- test_layout.py
- test_palette.py
- test_validation.py
- test_vis.py
- __init__.py
- __init__.py
- test_determinism.py
- test_exact_ir.py
- test_legacy_nauty.py
- __init__.py
- test_hier_context.py
- test_radius_expand.py
- __init__.py
- test_graph_descriptors.py
- test_graph_fps.py
- test_graph_signature.py
- test_hash_fps.py
- test_morgan_fps.py
- test_path_fps.py
- __init__.py
- test_api.py
- test_audit.py
- test_detector.py
- test_ring_system.py
- test_identity_search.py
- test_interface_constructor.py
- test_proof_document_digest.py
- test_proof_v2.py
- __init__.py
- test_graph_hydrogen.py
- test_hcomplete.py
- test_hcomplete_legacy.py
- test_misc.py
- __init__.py
- test_electron_aware_its.py
- test_its_construction.py
- test_its_destruction.py
- test_its_expand.py
- test_its_relabel.py
- test_normalize_aam.py
- test_stereo_layers.py
- __init__.py
- test_aut_est.py
- test_automorphism.py
- test_batch_cluster.py
- test_bipartite_mcs.py
- test_graph_cluster.py
- test_graph_matcher.py
- test_graph_morphism.py
- test_mcs_matcher.py
- test_orbit.py
- test_partial_matcher.py
- test_sing.py
- test_subgraph_matcher.py
- test_turbo_iso.py
- test_wl_sel.py
- test_conversion.py
- test_electron_accounting.py
- test_lwg_editor.py
- test_constraints.py
- test_llg_category.py
- test_morphism.py
- test_stereo_morphism.py
- test_stereo_morphism_policy.py
- test_stereo_transport.py
- __init__.py
- test_mtg.py
- test_mtg_tuple.py
- test_occurrence_history.py
- test_occurrence_process.py
- stereomolgraph_2d_fixtures.py
- test_axis_descriptors.py
- test_canonical_organic_stereograph.py
- test_canonical_stereograph.py
- test_canonical_stereograph_determinism.py
- test_configured_stereograph_families.py
- test_deduplication.py
- test_descriptors.py
- test_extended_cis_trans_descriptors.py
- test_global_stereo.py
- test_global_stereo_value.py
- test_helical_descriptors.py
- test_identity.py
- test_interchange.py
- test_legacy_oracle.py
- test_migration_closeout.py
- test_non_tetrahedral_descriptors.py
- test_orbit_descriptor_migration.py
- test_orbit_kernel.py
- test_pairwise_stereoisomer_relations.py
- test_reaction_composition.py
- test_reaction_interchange.py
- test_reaction_relations.py
- test_reaction_semantics.py
- test_reaction_transport_calculus.py
- test_reaction_wire.py
- test_stereograph_enumeration.py
- test_stereograph_mirror.py
- test_stereomolgraph_2d_cases.py
- test_stereomolgraph_graph_conformance.py
- test_stereomolgraph_semantics.py
- test_support_hierarchy.py
- __init__.py
- test_its_merge.py
- test_radwc.py
- test_wc_matcher.py
- test_wildcard.py
- __init__.py
- test_canon_graph.py
- test_syn_graph.py
- test_utils.py
- __init__.py
- test_smarts_expander.py
- test_smarts_generalizer.py
- test_smarts_to_graph.py
- __init__.py
- test_chemical_converter.py
- test_dfs_smiles.py
- test_gml_to_nx.py
- test_graph_to_mol.py
- test_mol_to_graph.py
- test_nx_to_gml.py
- test_benchmark_review.py
- test_electrocyclic_machinery.py
- test_evidence.py
- test_models.py
- test_phase2r_matrix.py
- test_replay.py
- test_stereo_branch_coverage.py
- test_stereo_workflow.py
- __init__.py
- test_dpo.py
- test_rule_matcher.py
- __init__.py
- test_composition.py
- test_composition_laws.py
- test_overlap_search.py
- test_synrule_native.py
- __init__.py
- test_molecule_rule.py
- test_rule_utils.py
- __init__.py
- test_generic_stereo.py
- test_generic_stereo_contract.py
- test_generic_stereo_six_geometry.py
- test_syn_rule.py
- __init__.py
- test_path_finder.py
- __init__.py
- test_engine.py
- test_fusion_contract.py
- test_verified_fusion_api.py
- test_verified_search.py
- small_rewrite_conformance.json
- __init__.py
- test_imba_engine.py
- test_non_tetrahedral_rewrite_conformance.py
- test_package_layout.py
- test_partial_engine.py
- test_promoted_stereo_rewrites.py
- test_rule_filter.py
- test_small_rewrite_conformance_data.py
- test_stereo_branch_algebra.py
- test_stereo_conformance_data.py
- test_stereo_coupling_corpus.py
- test_strategy.py
- test_syn_reactor_bug_cases.py
- test_syn_reactor_dedup_policy.py
- test_syn_reactor_electron_cases.py
- test_syn_reactor_real_cases.py
- test_syn_reactor_rewrite_modes.py
- test_syn_reactor_stereo_cases.py
- test_syn_reactor_stereo_outcomes.py
- __init__.py
- test_reactor_utils.py
- __init__.py
- test_embedding.py
- test_epd.py
- test_its_drawer.py
- test_molecule_drawer.py
- test_mtg_drawer.py
- test_namespaces.py
- test_reaction_drawer.py
- test_visual_drawer.py
- test_visual_model.py
- __init__.py
- test_python_file_size.py
- test_version.py
- .dockerignore
- .gitattributes
- .gitignore
- .readthedocs.yml
- crn.md
- Dockerfile
- environment.yml
- LICENSE
- pyproject.toml
- README.md
- requirements.txt
# Use via CDN
jsDelivrjsDelivr serves any public GitHub repository as a CDN with zero setup. Pick a version and a file to get a ready-to-paste link and snippet.
Link
Example
Command Glossary
Commands referenced in this DOCs, explained below.
docker pull
View Details ▼
docker pull
This command is an alias of `docker image pull`.
tldr docker image pull
View documentation for the original command:
docker run
View Details ▼
docker run
This command is an alias of `docker container run`.
tldr docker container run
View documentation for the original command:
git switch
View Details ▼
git switch
Switch between Git branches. Requires Git version 2.23+.
See also: `git checkout`.
git switch {{branch_name}}
Switch to an existing branch:
git switch {{[-c|--create]}} {{branch_name}}
Create a new branch and switch to it:
git switch {{[-c|--create]}} {{branch_name}} {{commit}}
Create a new branch based on an existing commit and switch to it:
python
View Details ▼
python
Python language interpreter.
python
Start a REPL (interactive shell):
python {{path/to/file.py}}
Execute a specific Python file:
python -i {{path/to/file.py}}
Execute a specific Python file and start a REPL:
# Project Badges
// repository documentation
Was this content helpful?
(0 ratings)