Chemistrylab package

Subpackages

• chemistrylab.vessel
  • Event
    • Event.name
    • Event.other_vessel
    • Event.parameter
  • Vessel
    • Vessel.filled_volume()
    • Vessel.get_layer_dataframe()
    • Vessel.get_layers()
    • Vessel.get_material_dataframe()
    • Vessel.get_solute_dataframe()
    • Vessel.heat_capacity()
    • Vessel.push_event_to_queue()
    • Vessel.register()
    • Vessel.validate_solutes()
    • Vessel.validate_solvents()
• chemistrylab.benches
  • Characterization Bench
    • CharacterizationBench
      • CharacterizationBench.encode_PVT()
      • CharacterizationBench.encode_target()
      • CharacterizationBench.get_layers()
      • CharacterizationBench.get_observation()
      • CharacterizationBench.get_spectra()
    • calc_absorb3()
  • Distillation Bench
    • GeneralWurtzDistill_v2
      • GeneralWurtzDistill_v2.action_space
      • GeneralWurtzDistill_v2.metadata
      • GeneralWurtzDistill_v2.observation_space
    • WurtzDistillDemo_v0
      • WurtzDistillDemo_v0.action_space
      • WurtzDistillDemo_v0.get_keys_to_action()
      • WurtzDistillDemo_v0.metadata
      • WurtzDistillDemo_v0.observation_space
    • wurtz_vessel()
  • Extraction Bench
    • GeneralWurtzExtract_v2
      • GeneralWurtzExtract_v2.action_space
      • GeneralWurtzExtract_v2.metadata
      • GeneralWurtzExtract_v2.observation_space
    • SeparateTest_v0
      • SeparateTest_v0.action_space
      • SeparateTest_v0.metadata
      • SeparateTest_v0.observation_space
    • WaterOilExtract_v0
      • WaterOilExtract_v0.action_space
      • WaterOilExtract_v0.metadata
      • WaterOilExtract_v0.observation_space
    • WurtzExtractDemo_v0
      • WurtzExtractDemo_v0.action_space
      • WurtzExtractDemo_v0.get_keys_to_action()
      • WurtzExtractDemo_v0.metadata
      • WurtzExtractDemo_v0.observation_space
    • make_solvent()
    • oil_vessel()
    • wurtz_vessel()
  • Reaction Bench
    • FictReactBandit_v0
      • FictReactBandit_v0.action_space
      • FictReactBandit_v0.observation_space
      • FictReactBandit_v0.step()
    • FictReactDemo_v0
      • FictReactDemo_v0.action_space
      • FictReactDemo_v0.get_keys_to_action()
      • FictReactDemo_v0.metadata
      • FictReactDemo_v0.observation_space
    • FictReact_v2
      • FictReact_v2.action_space
      • FictReact_v2.metadata
      • FictReact_v2.observation_space
    • GeneralWurtzReact_v0
      • GeneralWurtzReact_v0.action_space
      • GeneralWurtzReact_v0.metadata
      • GeneralWurtzReact_v0.observation_space
    • GeneralWurtzReact_v2
      • GeneralWurtzReact_v2.action_space
      • GeneralWurtzReact_v2.metadata
      • GeneralWurtzReact_v2.observation_space
    • get_mat()
  • General Bench
    • Action
      • Action.affected_vessels
      • Action.dt
      • Action.event_name
      • Action.parameters
      • Action.terminal
      • Action.vessels
    • ContinuousParam
      • ContinuousParam.max_val
      • ContinuousParam.min_val
      • ContinuousParam.other
      • ContinuousParam.thresh
    • GenBench
      • GenBench.action_space
      • GenBench.build_event()
      • GenBench.get_vessels()
      • GenBench.observation_space
      • GenBench.render()
      • GenBench.reset()
      • GenBench.step()
      • GenBench.update_vessels()
    • default_reward()
• chemistrylab.extract_algorithms
  • chemistrylab.extract_algorithms.separate
    • map_to_state()
    • mix()
• chemistrylab.lab
  • chemistrylab.lab.lab
    • Lab
      • Lab.action_space
      • Lab.load_distillation_bench()
      • Lab.load_extraction_bench()
      • Lab.load_reaction_bench()
      • Lab.observation_space
      • Lab.register_agent()
      • Lab.reset()
      • Lab.run_bench()
      • Lab.step()
  • chemistrylab.lab.manager
    • Manager
      • Manager.create_new_vessel()
      • Manager.list_vessels()
      • Manager.load_bench()
      • Manager.load_vessel()
      • Manager.register_agent()
      • Manager.register_bench_agent()
      • Manager.run()
      • Manager.save_vessel()
  • chemistrylab.lab.shelf
    • Shelf
      • Shelf.append()
      • Shelf.get_vessels()
      • Shelf.get_working_vessels()
      • Shelf.load_vessel()
      • Shelf.pop()
      • Shelf.reset()
    • VariableShelf
      • VariableShelf.reset()
• chemistrylab.reactions
  • chemistrylab.reactions.reaction
    • Reaction
      • Reaction.react()
      • Reaction.update_concentrations()
    • get_rates()
    • newton_solve()
    • react()
  • chemistrylab.reactions.reaction_info
    • ReactInfo
      • ReactInfo.MATERIALS
      • ReactInfo.PRODUCTS
      • ReactInfo.REACTANTS
      • ReactInfo.SOLVENTS
      • ReactInfo.activ_energy_arr
      • ReactInfo.conc_coeff_arr
      • ReactInfo.dump_to_json()
      • ReactInfo.from_json()
      • ReactInfo.name
      • ReactInfo.pre_exp_arr
      • ReactInfo.stoich_coeff_arr
    • format_2d_array_string()
    • serial()
• chemistrylab.util
  • chemistrylab.util.Visualization
    • Visualizer()
    • fill_line()
    • matplotVisualizer
      • matplotVisualizer.display_vessels()
      • matplotVisualizer.get_rgb()
      • matplotVisualizer.legend_update_delay
      • matplotVisualizer.render_PVT()
      • matplotVisualizer.render_layers()
      • matplotVisualizer.render_spectra()
      • matplotVisualizer.render_target()
    • numbaVisualizer
      • numbaVisualizer.get_rgb()
      • numbaVisualizer.render_PVT()
      • numbaVisualizer.render_layers()
      • numbaVisualizer.render_spectra()
      • numbaVisualizer.render_target()
    • pygameVisualizer
      • pygameVisualizer.get_rgb()
      • pygameVisualizer.render_PVT()
      • pygameVisualizer.render_layers()
      • pygameVisualizer.render_spectra()
      • pygameVisualizer.render_target()
    • set_backend()
    • to_rgb()
    • use_mpl_dark()
    • use_mpl_light()
  • chemistrylab.util.reward
    • RewardGenerator
      • RewardGenerator.__call__()
    • get_dissolved_amounts()
• chemistrylab.material
  • A
  • Air
  • B
  • C
  • C6H14
  • Cl
    • Cl.precipitate()
  • Cl2
  • CuSO4
  • CuSO4Pentahydrate
  • D
  • DiEthylEther
  • Dodecane
  • E
  • Ethoxyethane
  • EthylAcetate
  • F
  • F2
  • FiveMethylundecane
  • FiveSixDimethyldecane
  • FourEthylFiveMethylnonane
  • FourEthyldecane
  • FourFiveDiethyloctane
  • G
  • H
  • H2
  • H2O
  • HCl
  • I
  • Li
  • LiF
  • Material
    • Material.boiling_point
    • Material.dissolve()
    • Material.enthalpy_vapor()
    • Material.get_color
    • Material.get_density()
    • Material.get_index()
    • Material.get_name()
    • Material.get_spectra_no_overlap()
    • Material.get_spectra_overlap()
    • Material.heat_capacity
    • Material.is_solute()
    • Material.is_solvent()
    • Material.litres
    • Material.litres_per_mol
    • Material.melting_point
    • Material.molar_mass
    • Material.precipitate()
    • Material.ration()
    • Material.set_color()
    • Material.set_enthalpy_fusion()
    • Material.set_solute_flag()
    • Material.set_solvent_flag()
    • Material.set_specific_heat()
    • Material.vapour_enthalpy
  • MethylRed
  • Na
    • Na.precipitate()
  • NaCl
    • NaCl.dissolve()
  • O
  • O2
  • O3
  • OneChlorohexane
  • ThreeChlorohexane
  • TwoChlorohexane
  • register()