diff --git a/.env b/.env index e2abc4b..d36d333 100644 --- a/.env +++ b/.env @@ -1,3 +1,3 @@ MODS_MOCK_AGENT_VERSION=0.7.0 -SIM_CMCL_MODS_WRAPPER_VERSION=0.11.0 +SIM_CMCL_MODS_WRAPPER_VERSION=0.12.0 MODS_AGENT_BASE_URL=https://kg.cmclinnovations.com/mods-agent \ No newline at end of file diff --git a/README.md b/README.md index 93c214b..547770d 100644 --- a/README.md +++ b/README.md @@ -15,11 +15,11 @@ The mock version of the MoDS web agent is additionally provided for testing and # Requirements - Python 3.8 (or higher) -- [SimPhoNy](https://github.com/simphony/osp-core) +- [SimPhoNy 3.8](https://github.com/simphony/simphony-osp/tree/v3.8.0) # Installation - docker -A convenience `docker_install.sh` script has been provided that creates the `cmcl/sim_cmcl_mods_wrapper` image. +A convenient `docker_install.sh` script has been provided that creates the `cmcl/sim_cmcl_mods_wrapper` image. ```bash # build the cmcl/sim_cmcl_mods_wrapper image @@ -41,7 +41,7 @@ Please follow these steps to install the wrapper on your machine (using the virt # Usage -The mods wrapper can be used by either running it in a docker container or locally. In case of the docker container option, a convenience `run_container.sh` script has been provided to simplify this task: +The mods wrapper can be used by either running it in a docker container or locally. In case of the docker container option, a convenient `run_container.sh` script has been provided to simplify this task: ```bash # run the sim_cmcl_mods_wrapper container and open its bash terminal @@ -52,7 +52,6 @@ Regardless of the docker or local machine option for building and running the wr ```bash python examples/moo.py - python examples/moo_analytic.py ``` Please note that the above examples depend on the mods agent instance being up and running on CMCL servers. diff --git a/docker-compose.yml b/docker-compose.yml index 7410e1e..a7e38c3 100644 --- a/docker-compose.yml +++ b/docker-compose.yml @@ -12,3 +12,5 @@ services: container_name: sim_cmcl_mods_wrapper ports: - 5001:5000 + volumes: + - ./examples:/simphony/mods-wrapper/examples/ diff --git a/examples/DriveCycle/EngineSurrogateInput.csv b/examples/DriveCycle/EngineSurrogateInput.csv new file mode 100644 index 0000000..1187b8c --- /dev/null +++ b/examples/DriveCycle/EngineSurrogateInput.csv @@ -0,0 +1,18002 @@ +Time [s],Engine 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new file mode 100644 index 0000000..b4fff47 --- /dev/null +++ b/examples/DriveCycle/drive_cycle.py @@ -0,0 +1,358 @@ +import logging +from osp.core.namespaces import mods, cuba +from osp.core.utils import pretty_print, export_cuds, import_cuds +import osp.core.utils.simple_search as search +import osp.wrappers.sim_cmcl_mods_wrapper.mods_session as ms +from dotenv import load_dotenv +import urllib.parse +import csv +import numpy as np +import os + +from pathlib import Path +dir_path = Path(__file__).parent.resolve() + +DO_EXPORT = True +FORCE_RESTART = True + +# This examples aims to run the success story by hard-coding +# the input CUDS objects and passing them to the MoDS_Session class +# for execution. + + +def readcsvintodict(fn): + # return a dictionary with headers as keys, columns as values + dict_out = {} + with open(fn, 'r') as f: + NK = csv.reader(f) + content = [row for row in NK] + header = content[0] + dict_idx = {} + for i in range(len(header)): + dict_idx[i] = header[i] + for i in range(len(header)): + dict_out[header[i]] = [] + for i in range(1, len(content)): + for j in range(len(content[i])): + try: + dict_out[dict_idx[j]].append(float(content[i][j])) + except: + dict_out[dict_idx[j]].append(content[i][j]) + return dict_out + + +def getdrivecycle(path_input, n): + # read drive cycle input data, then interpolate into n points (affect run time) + drive_cycle = readcsvintodict(path_input) + time = np.linspace(0, 1800.0, n) + old_time = drive_cycle["Time [s]"] + for key in drive_cycle.keys(): + drive_cycle[key] = np.interp(time, old_time, drive_cycle[key]) + return drive_cycle + + +def populateDataset(aDataset, data): + # given input data, create Dataset instance + data_header = data[0] + data_values = data[1:] + + for row in data_values: + data_point = mods.DataPoint() + for header, value in zip(data_header, row): + data_point.add(mods.DataPointItem( + name=header, value=value), rel=mods.hasPart) + aDataset.add(data_point, rel=mods.hasPart) + return aDataset + + +def prepare_evaluate(logger, surrogateToLoad, inputs, outputs, time): + # define inputs for an "Evaluate" simulation. + logger.info("################ Start: Evaluate ################") + logger.info("Loading surrogate: "+surrogateToLoad) + logger.info("Setting up the simulation inputs") + + evaluate_simulation = mods.EvaluateSurrogate() + hdmr_algorithm = mods.Algorithm( + name="algorithm1", type="GenSurrogateAlg", surrogateToLoad=surrogateToLoad, saveSurrogate=False) + evaluate_simulation.add(hdmr_algorithm) + evaluate_algorithm = mods.Algorithm( + name="algorithm2", type="SamplingAlg", saveSurrogate=False) + for input in inputs: + evaluate_algorithm.add(mods.Variable(name=input["name"], type="input")) + for output in outputs: + evaluate_algorithm.add(mods.Variable( + name=output["name"], type="output")) + evaluate_simulation.add(evaluate_algorithm) + + example_data = [] + example_data.append(["Time [s]"]+[input["name"] for input in inputs]) + for i in range(len(inputs[0]["values"])): + example_data.append([time[i]]+[input["values"][i] for input in inputs]) + + input_data = populateDataset(mods.InputData(), example_data) + + evaluate_simulation.add(input_data) + + return evaluate_simulation + + +def prepare_twc_thermal(logger, modelToLoad, time, temperature, massflowrate): + # define inputs for the TWC thermal simulation. + logger.info("################ Start: TWC thermal model ################") + logger.info("Setting up the simulation inputs") + + twc_thermal_simulation = mods.SampleSRM() + twc_thermal_algorithm = mods.Algorithm( + name="algorithm1", type="SamplingAlg", modelToLoad=modelToLoad, saveSurrogate=False) + x_value = ",".join(["{:.1f}".format(float(t)) for t in time]) + initialreaddetail = mods.InitialReadDetail(x_column="Time [s]", y_column="Wall Temperature at volume element 30 [K]", + x_value=x_value, read_function="Get_DSV_y_at_x_double", + lb_factor="0.9", ub_factor="1.1", lb_append="-0.0", ub_append="0.0", + file="OutputCase00001Cyc0001Monolith001Layer001WallTemperature.csv") + workingreaddetail = mods.WorkingReadDetail(x_column="Time [s]", y_column="Wall Temperature at volume element 30 [K]", + x_value=x_value, read_function="Get_DSV_y_at_x_double") + wall_temperature = mods.Variable( + name="WallTemperature%20%28Layer%201%2C%20Vol%2E%20element%2030%29", type="output", nParams=str(len(time))) + wall_temperature.add(workingreaddetail, rel=mods.hasPart) + wall_temperature.add(initialreaddetail, rel=mods.hasPart) + twc_thermal_algorithm.add( + mods.Variable(name="Gas%20flow%20rate", type="input", + path="/srm_inputs/exhaust_aftertreatment/connection[@index='1'][@name='Main Inlet']/massflowrate/value"), + mods.Variable(name="Environment%20temperature", type="input", + path="/srm_inputs/exhaust_aftertreatment/monolith[@index='1'][@name='Monolith #1']/gas/temperature/value"), + wall_temperature + ) + + twc_thermal_simulation.add(twc_thermal_algorithm) + + input_data = populateDataset(mods.InputData( + ), [["Gas%20flow%20rate", "Environment%20temperature"], [60000.0, 605.0]]) + + twc_thermal_simulation.add(input_data) + + output_data = populateDataset(mods.OutputData( + ), [["WallTemperature%20%28Layer%201%2C%20Vol%2E%20element%2030%29"], [300.0]]) + + twc_thermal_simulation.add(output_data) + + twc_thermal_simulation.add( + mods.File(file="OutputCase00001Cyc0001Monolith001Layer001WallTemperature.csv")) + + model_input = mods.ModelInput(path="All/Temperature.csv") + + example_model_input_data = [["Time", "Temperature"]] + for i in range(len(time)): + example_model_input_data.append([time[i], temperature[i]]) + + model_input_data = populateDataset( + mods.DataSet(), example_model_input_data) + + model_input.add(model_input_data, rel=mods.hasPart) + + twc_thermal_simulation.add(model_input) + + model_input = mods.ModelInput(path="All/MassFlowRate.csv") + + example_model_input_data = [["Time", "Mass Flow Rate"]] + for i in range(len(time)): + example_model_input_data.append([time[i], massflowrate[i]]) + + model_input_data = populateDataset( + mods.DataSet(), example_model_input_data) + + model_input.add(model_input_data, rel=mods.hasPart) + + twc_thermal_simulation.add(model_input) + + return twc_thermal_simulation + + +def run(logger, simulation, export_name=None): + # call MoDSSimpleAgent via wrapper, then get output data back + + logger.info("Invoking the wrapper session") + # Construct a wrapper and run a new session + with ms.MoDS_Session() as session: + wrapper = cuba.wrapper(session=session) + wrapper.add(simulation, rel=cuba.relationship) + wrapper.session.run() + + sim = search.find_cuds_objects_by_oclass( + mods.Simulation, wrapper, rel=None)[0] + + output_data = search.find_cuds_objects_by_oclass( + mods.OutputData, sim, rel=None) + + if output_data: + if export_name: + if DO_EXPORT: + export_cuds(sim, file=os.path.join( + dir_path, export_name+".ttl"), format="ttl") + return sim + else: + pretty_print(sim) + raise RuntimeError("No output is present.") + + +def outputtodict(sim, find_time=True): + + # convert output data into a dictionary object + + output = {} + + output_data = search.find_cuds_objects_by_oclass( + mods.OutputData, sim, rel=None)[-1] + + datapoints = search.find_cuds_objects_by_oclass( + mods.DataPoint, output_data, rel=mods.hasPart) + for datapoint in datapoints: + if find_time: + # copy time from input + input_datapoint = datapoint.get(rel=mods.isDerivedFrom)[0] + input_datapointitems = search.find_cuds_objects_by_oclass( + mods.DataPointItem, input_datapoint, rel=mods.hasPart) + for datapointitem in input_datapointitems: + name = datapointitem.name + value = datapointitem.value + if "Time" in datapointitem.name: + if name not in output.keys(): + output[name] = [value] + else: + output[name].append(value) + datapointitems = search.find_cuds_objects_by_oclass( + mods.DataPointItem, datapoint, rel=mods.hasPart) + for datapointitem in datapointitems: + name = datapointitem.name + value = datapointitem.value + if name not in output.keys(): + output[name] = [value] + else: + output[name].append(value) + + if find_time: + # sort everything by time + arr_time = [float(x) for x in output["Time [s]"]] + index = np.argsort(arr_time) + for var in output: + output[var] = [output[var][i] for i in index] + + return output + + +def create_input_cuds(path_input, n): + if not FORCE_RESTART: + try: + input_cuds_object = import_cuds(os.path.join( + dir_path, "drive_cycle_input.ttl"), format="ttl") + logger.info("Load input from CUDS") + return input_cuds_object + except ValueError: + pass + # create input CUDS object by code + + logger.info("Create input from CSV") + engine_inputs = [{"name": "Engine%20speed%20%5BRPM%5D"}, + {"name": "BMEP%20%5Bbar%5D"}] + engine_outputs = [{"name": "CO%20mass%20fraction%20%5B%2D%5D"}, + {"name": "CO2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "C3H6%20mass%20fraction%20%5B%2D%5D"}, + {"name": "H2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "H2O%20mass%20fraction%20%5B%2D%5D"}, + {"name": "NO%20mass%20fraction%20%5B%2D%5D"}, + {"name": "O2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "N2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Temperature%20%5BK%5D"}, + {"name": "Total%20flow%20%5Bg%2Fh%5D"} + ] + + # number of points will affect runtime + drive_cycle = getdrivecycle(path_input, n) + + for input in engine_inputs: + input["values"] = drive_cycle[urllib.parse.unquote(input["name"])] + input_cuds_object = prepare_evaluate( + logger, "engine-surrogate", engine_inputs, engine_outputs, drive_cycle['Time [s]']) + return input_cuds_object + + +def mods_wrapper(input_cuds_object): + + # evaluate engine surrogate, store output cuds in dictionary + + logger.info("Call engine surroate") + + engine_out = outputtodict( + run(logger, input_cuds_object, "drive_cycle_engine_out")) + + # evaluate TWC thermal simulation, store output cuds in dictionary + + logger.info("Call TWC thermal model") + + twc_thermal_out = outputtodict( + run(logger, prepare_twc_thermal(logger, "twc-thermal", + engine_out["Time [s]"], + engine_out["Temperature [K]"], + engine_out["Total flow [g/h]"]), + "drive_cycle_twc_thermal"), + find_time=False + ) + + # create input for TWC surrogate + + twc_inputs = [{"name": "Temperature%20%5BK%5D"}, + {"name": "Total%20flow%20%5Bg%2Fh%5D"}, + {"name": "Inlet%20CO%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Inlet%20CO2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Inlet%20C3H6%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Inlet%20H2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Inlet%20H2O%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Inlet%20NO%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Inlet%20O2%20mass%20fraction%20%5B%2D%5D"} + ] + twc_outputs = [{"name": "Outlet%20CO%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Outlet%20CO2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Outlet%20C3H6%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Outlet%20H2%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Outlet%20H2O%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Outlet%20NO%20mass%20fraction%20%5B%2D%5D"}, + {"name": "Outlet%20O2%20mass%20fraction%20%5B%2D%5D"} + ] + + for input in twc_inputs: + input["values"] = engine_out[urllib.parse.unquote( + input["name"]).replace("Inlet ", "")] + if "Temperature" in input["name"]: + input["values"] = twc_thermal_out["WallTemperature (Layer 1, Vol. element 30)"] + + # evaluate TWC surrogate + + logger.info("Call TWC surroate") + + return run(logger, prepare_evaluate(logger, "twc-model-6", twc_inputs, twc_outputs, engine_out["Time [s]"])) + + +if __name__ == "__main__": + + logging.getLogger( + "osp.wrappers.sim_cmcl_mods_wrapper").setLevel(logging.ERROR) + logger = logging.getLogger(__name__) + logger.setLevel(logging.INFO) + logger.addHandler(logging.StreamHandler()) + logger.handlers[0].setFormatter(logging.Formatter( + "%(levelname)s %(asctime)s [%(name)s]: %(message)s")) + logger.info("Loading environment variables") + load_dotenv() + # os.environ["MODS_AGENT_BASE_URL"]="http://localhost:58085" + + input_cuds_object = create_input_cuds( + os.path.join(dir_path, "EngineSurrogateInput.csv"), 181) + + if DO_EXPORT: + export_cuds(input_cuds_object, file=os.path.join( + dir_path, "drive_cycle_input.ttl"), format="ttl") + + output_cuds_object = mods_wrapper(input_cuds_object) + + if DO_EXPORT: + export_cuds(output_cuds_object, file=os.path.join( + dir_path, "drive_cycle_output.ttl"), format="ttl") diff --git a/examples/DriveCycle/engine_surrogate.py b/examples/DriveCycle/engine_surrogate.py new file mode 100644 index 0000000..fbc73a2 --- /dev/null +++ b/examples/DriveCycle/engine_surrogate.py @@ -0,0 +1,149 @@ +import logging +from osp.core.namespaces import mods, cuba +from osp.core.utils import pretty_print, export_cuds +import osp.core.utils.simple_search as search +import osp.wrappers.sim_cmcl_mods_wrapper.mods_session as ms +from dotenv import load_dotenv +import os + +from pathlib import Path +dir_path = Path(__file__).parent.resolve() + +logger = logging.getLogger(__name__) +logger.setLevel(logging.DEBUG) +logger.addHandler(logging.StreamHandler()) +logger.handlers[0].setFormatter( + logging.Formatter("%(levelname)s %(asctime)s [%(name)s]: %(message)s") +) + +# This examples aims to run a engine surrogate by hard-coding +# the input CUDS objects and passing them to the MoDS_Session class +# for execution. + + +def evaluate_example(surrogateToLoad="engine-surrogate"): + logger.info("################ Start: Engine Surrogate ################") + load_dotenv() + # os.environ["MODS_AGENT_BASE_URL"]="http://localhost:58085" + logger.info("Setting up the simulation inputs") + + evaluate_simulation = mods.EvaluateSurrogate() + + hdmr_algorithm = mods.Algorithm( + name="algorithm1", type="GenSurrogateAlg", surrogateToLoad=surrogateToLoad, saveSurrogate=False) + evaluate_simulation.add(hdmr_algorithm) + + evaluate_algorithm = mods.Algorithm( + name="algorithm2", type="SamplingAlg", saveSurrogate=False) + evaluate_algorithm.add( + mods.Variable(name="Engine%20speed%20%5BRPM%5D", type="input"), + mods.Variable(name="BMEP%20%5Bbar%5D", type="input"), + mods.Variable(name="CO%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="CO2%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="C3H6%20mass%20fraction%20%5B%2D%5D", + type="output"), + mods.Variable(name="H2%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="H2O%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="NO%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="O2%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="N2%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable(name="Temperature%20%5BK%5D", type="output"), + mods.Variable(name="Total%20flow%20%5Bg%2Fh%5D", type="output") + ) + + evaluate_simulation.add(evaluate_algorithm) + + example_data = [ + ["Time%5Bs%5D", "Engine%20speed%20%5BRPM%5D", "BMEP%20%5Bbar%5D"], + [0.0, 1000.0, 1.0], + [900.0, 1500.0, 5.0], + [1800.0, 2000.0, 10.0] + ] + + example_data_header = example_data[0] + example_data_values = example_data[1:] + + input_data = mods.InputData() + + for row in example_data_values: + data_point = mods.DataPoint() + for header, value in zip(example_data_header, row): + data_point.add( + mods.DataPointItem(name=header, value=value), + rel=mods.hasPart, + ) + input_data.add(data_point, rel=mods.hasPart) + + evaluate_simulation.add(input_data) + + export_cuds(evaluate_simulation, file=os.path.join( + dir_path, "engine_in.ttl"), format="ttl") + + logger.info("Invoking the wrapper session") + # Construct a wrapper and run a new session + with ms.MoDS_Session() as session: + wrapper = cuba.wrapper(session=session) + wrapper.add(evaluate_simulation, rel=cuba.relationship) + wrapper.session.run() + + output_data = search.find_cuds_objects_by_oclass( + mods.OutputData, wrapper, rel=None + ) + job_id = search.find_cuds_objects_by_oclass( + mods.JobID, wrapper, rel=None + ) + + logger.info("Printing the simulation results.") + + if output_data: + pretty_print(output_data[0]) + + if job_id: + pretty_print(job_id[0]) + + eva = search.find_cuds_objects_by_oclass( + mods.EvaluateSurrogate, wrapper, rel=None + ) + + export_cuds(eva[0], file=os.path.join( + dir_path, "engine_all.ttl"), format="ttl") + + export_cuds(output_data[0], file=os.path.join( + dir_path, "engine_out.ttl"), format="ttl") + + input_data = search.find_cuds_objects_by_oclass( + mods.InputData, wrapper, rel=None + )[0] + + list_input_data_point = search.find_cuds_objects_by_oclass( + mods.DataPoint, input_data, rel=mods.hasPart + ) + + input_name = "Time" + output_name = "Temperature" + + for input_data_point in list_input_data_point: + input_value = find_data_point_item_by_name( + input_data_point, input_name) + output_data_point = input_data_point.get(rel=mods.isSourceOf)[0] + output_value = find_data_point_item_by_name( + output_data_point, output_name) + print("%s=%s,%s=%s" % + (input_name, input_value, output_name, output_value)) + + logger.info("################ End: Engine Surrogate ################") + + return output_data + + +def find_data_point_item_by_name(data_point, name): + items = search.find_cuds_objects_by_oclass( + mods.DataPointItem, data_point, rel=mods.hasPart + ) + for item in items: + if name in item.name: + return item.value + + +if __name__ == "__main__": + evaluate_example() diff --git a/examples/DriveCycle/twc_surrogate.py b/examples/DriveCycle/twc_surrogate.py new file mode 100644 index 0000000..fa729cf --- /dev/null +++ b/examples/DriveCycle/twc_surrogate.py @@ -0,0 +1,169 @@ +import logging +from osp.core.namespaces import mods, cuba +from osp.core.utils import pretty_print, export_cuds +import osp.core.utils.simple_search as search +import osp.wrappers.sim_cmcl_mods_wrapper.mods_session as ms +from dotenv import load_dotenv +import os + +from pathlib import Path +dir_path = Path(__file__).parent.resolve() + +logger = logging.getLogger(__name__) +logger.setLevel(logging.DEBUG) +logger.addHandler(logging.StreamHandler()) +logger.handlers[0].setFormatter( + logging.Formatter("%(levelname)s %(asctime)s [%(name)s]: %(message)s") +) + +# This examples aims to run a TWC surrogate by hard-coding +# the input CUDS objects and passing them to the MoDS_Session class +# for execution. + + +def evaluate_example(surrogateToLoad="twc-model-6"): + logger.info("################ Start: TWC Surrogate ################") + load_dotenv() + # os.environ["MODS_AGENT_BASE_URL"]="http://localhost:58085" + logger.info("Setting up the simulation inputs") + + evaluate_simulation = mods.EvaluateSurrogate() + + hdmr_algorithm = mods.Algorithm( + name="algorithm1", type="GenSurrogateAlg", surrogateToLoad=surrogateToLoad, saveSurrogate=False) + evaluate_simulation.add(hdmr_algorithm) + + evaluate_algorithm = mods.Algorithm( + name="algorithm2", type="SamplingAlg", saveSurrogate=False) + evaluate_algorithm.add( + mods.Variable(name="Temperature%20%5BK%5D", type="input"), + mods.Variable(name="Total%20flow%20%5Bg%2Fh%5D", type="input"), + mods.Variable( + name="Inlet%20CO%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Inlet%20CO2%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Inlet%20C3H6%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Inlet%20H2%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Inlet%20H2O%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Inlet%20NO%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Inlet%20O2%20mass%20fraction%20%5B%2D%5D", type="input"), + mods.Variable( + name="Outlet%20CO%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable( + name="Outlet%20CO2%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable( + name="Outlet%20C3H6%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable( + name="Outlet%20H2%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable( + name="Outlet%20H2O%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable( + name="Outlet%20NO%20mass%20fraction%20%5B%2D%5D", type="output"), + mods.Variable( + name="Outlet%20O2%20mass%20fraction%20%5B%2D%5D", type="output") + ) + + evaluate_simulation.add(evaluate_algorithm) + + example_data = [ + ["Time%5Bs%5D", "Temperature%20%5BK%5D", "Total%20flow%20%5Bg%2Fh%5D", + "Inlet%20CO%20mass%20fraction%20%5B%2D%5D", "Inlet%20CO2%20mass%20fraction%20%5B%2D%5D", + "Inlet%20C3H6%20mass%20fraction%20%5B%2D%5D", "Inlet%20H2%20mass%20fraction%20%5B%2D%5D", + "Inlet%20H2O%20mass%20fraction%20%5B%2D%5D", "Inlet%20NO%20mass%20fraction%20%5B%2D%5D", "Inlet%20O2%20mass%20fraction%20%5B%2D%5D"], + [0., 300., 9614., 0.00423872, 0.070268, 0.0205358, + 7.336e-5, 0.053835, 0.0012947, 0.07026804], + [1800., 908., 10626., 0.003077, 0.04493, 0.013256, + 5.7013293e-5, 0.063, 0.001863, 0.0449314] + ] + + example_data_header = example_data[0] + example_data_values = example_data[1:] + + input_data = mods.InputData() + + for row in example_data_values: + data_point = mods.DataPoint() + for header, value in zip(example_data_header, row): + data_point.add( + mods.DataPointItem(name=header, value=value), + rel=mods.hasPart, + ) + input_data.add(data_point, rel=mods.hasPart) + + evaluate_simulation.add(input_data) + + export_cuds(evaluate_simulation, file=os.path.join( + dir_path, "twc_in.ttl"), format="ttl") + + logger.info("Invoking the wrapper session") + # Construct a wrapper and run a new session + with ms.MoDS_Session() as session: + wrapper = cuba.wrapper(session=session) + wrapper.add(evaluate_simulation, rel=cuba.relationship) + wrapper.session.run() + + output_data = search.find_cuds_objects_by_oclass( + mods.OutputData, wrapper, rel=None + ) + job_id = search.find_cuds_objects_by_oclass( + mods.JobID, wrapper, rel=None + ) + + logger.info("Printing the simulation results.") + + if output_data: + pretty_print(output_data[0]) + if job_id: + pretty_print(job_id[0]) + + eva = search.find_cuds_objects_by_oclass( + mods.EvaluateSurrogate, wrapper, rel=None + ) + + export_cuds(eva[0], file=os.path.join( + dir_path, "twc_all.ttl"), format="ttl") + + export_cuds(output_data[0], file=os.path.join( + dir_path, "twc_out.ttl"), format="ttl") + + input_data = search.find_cuds_objects_by_oclass( + mods.InputData, wrapper, rel=None + )[0] + + list_input_data_point = search.find_cuds_objects_by_oclass( + mods.DataPoint, input_data, rel=mods.hasPart + ) + + input_name = "Time" + output_name = "CO2" + + for input_data_point in list_input_data_point: + input_value = find_data_point_item_by_name( + input_data_point, input_name) + output_data_point = input_data_point.get(rel=mods.isSourceOf)[0] + output_value = find_data_point_item_by_name( + output_data_point, output_name) + print("%s=%s,%s=%s" % + (input_name, input_value, output_name, output_value)) + + logger.info("################ End: TWC Surrogate ################") + + return output_data + + +def find_data_point_item_by_name(data_point, name): + items = search.find_cuds_objects_by_oclass( + mods.DataPointItem, data_point, rel=mods.hasPart + ) + for item in items: + if name in item.name: + return item.value + + +if __name__ == "__main__": + evaluate_example() diff --git a/examples/DriveCycle/twc_thermal.py b/examples/DriveCycle/twc_thermal.py new file mode 100644 index 0000000..0addd3f --- /dev/null +++ b/examples/DriveCycle/twc_thermal.py @@ -0,0 +1,166 @@ +import logging +from osp.core.namespaces import mods, cuba +from osp.core.utils import pretty_print, export_cuds +import osp.core.utils.simple_search as search +import osp.wrappers.sim_cmcl_mods_wrapper.mods_session as ms +from dotenv import load_dotenv +import os + +from pathlib import Path +dir_path = Path(__file__).parent.resolve() + +logger = logging.getLogger(__name__) +logger.setLevel(logging.DEBUG) +logger.addHandler(logging.StreamHandler()) +logger.handlers[0].setFormatter( + logging.Formatter("%(levelname)s %(asctime)s [%(name)s]: %(message)s") +) + +# This examples aims to run the TWC warmup case in SRM by hard-coding +# the input CUDS objects and passing them to the MoDS_Session class +# for execution. + + +def populateDataset(aDataset, data): + data_header = data[0] + data_values = data[1:] + + for row in data_values: + data_point = mods.DataPoint() + for header, value in zip(data_header, row): + data_point.add( + mods.DataPointItem(name=header, value=value), + rel=mods.hasPart, + ) + aDataset.add(data_point, rel=mods.hasPart) + return aDataset + + +def evaluate_example(modelToLoad="twc-thermal"): + logger.info( + "################ Start: TWC thermal model ################") + logger.info("Loading environment variables") + load_dotenv() + logger.info("Setting up the simulation inputs") + + twc_thermal_simulation = mods.SampleSRM() + + twc_thermal_algorithm = mods.Algorithm( + name="algorithm1", type="SamplingAlg", modelToLoad=modelToLoad, saveSurrogate=False) + x_value = ",".join(["{:.1f}".format(i) for i in range(1801)]) + initialreaddetail = mods.InitialReadDetail(x_column="Time [s]", y_column="Wall Temperature at volume element 30 [K]", + x_value=x_value, read_function="Get_DSV_y_at_x_double", + lb_factor="0.9", ub_factor="1.1", lb_append="-0.0", ub_append="0.0", + file="OutputCase00001Cyc0001Monolith001Layer001WallTemperature.csv") + workingreaddetail = mods.WorkingReadDetail(x_column="Time [s]", y_column="Wall Temperature at volume element 30 [K]", + x_value=x_value, read_function="Get_DSV_y_at_x_double") + wall_temperature = mods.Variable( + name="WallTemperature%20%28Layer%201%2C%20Vol%2E%20element%2030%29", type="output", nParams="1801") + wall_temperature.add(workingreaddetail, rel=mods.hasPart) + wall_temperature.add(initialreaddetail, rel=mods.hasPart) + twc_thermal_algorithm.add( + mods.Variable(name="Gas%20flow%20rate", type="input", + path="/srm_inputs/exhaust_aftertreatment/connection[@index='1'][@name='Main Inlet']/massflowrate/value"), + mods.Variable(name="Environment%20temperature", type="input", + path="/srm_inputs/exhaust_aftertreatment/monolith[@index='1'][@name='Monolith #1']/gas/temperature/value"), + wall_temperature + ) + + twc_thermal_simulation.add(twc_thermal_algorithm) + + example_input_data = [ + ["Gas%20flow%20rate", "Environment%20temperature"], + [60000.0, 605.0] + ] + + input_data = populateDataset(mods.InputData(), example_input_data) + + twc_thermal_simulation.add(input_data) + + example_output_data = [ + ["WallTemperature%20%28Layer%201%2C%20Vol%2E%20element%2030%29"], + [300.0] + ] + + output_data = populateDataset(mods.OutputData(), example_output_data) + + twc_thermal_simulation.add(output_data) + + file = mods.File( + file="OutputCase00001Cyc0001Monolith001Layer001WallTemperature.csv") + + twc_thermal_simulation.add(file) + + model_input = mods.ModelInput(path="All/Temperature.csv") + + example_model_input_data = [ + ["Time", "Temperature"], + [0., 700.], + [1800., 1000.] + ] + + model_input_data = populateDataset( + mods.DataSet(), example_model_input_data) + + model_input.add(model_input_data, rel=mods.hasPart) + + twc_thermal_simulation.add(model_input) + + model_input = mods.ModelInput(path="All/MassFlowRate.csv") + + example_model_input_data = [ + ["Time", "Mass Flow Rate"], + [0., 10000.], + [1800., 20000.] + ] + + model_input_data = populateDataset( + mods.DataSet(), example_model_input_data) + + model_input.add(model_input_data, rel=mods.hasPart) + + twc_thermal_simulation.add(model_input) + + export_cuds(twc_thermal_simulation, file=os.path.join( + dir_path, "twc_thermal_in.ttl"), format="ttl") + + logger.info("Invoking the wrapper session") + # Construct a wrapper and run a new session + with ms.MoDS_Session() as session: + wrapper = cuba.wrapper(session=session) + wrapper.add(twc_thermal_simulation, rel=cuba.relationship) + wrapper.session.run() + + output_data = search.find_cuds_objects_by_oclass( + mods.OutputData, wrapper, rel=None + ) + job_id = search.find_cuds_objects_by_oclass( + mods.JobID, wrapper, rel=None + ) + + logger.info("Printing the simulation results.") + + if output_data: + # output_data[0] is the one created above as part of input + pretty_print(output_data[1]) + + if job_id: + pretty_print(job_id[0]) + + sampleSRM = search.find_cuds_objects_by_oclass( + mods.SampleSRM, wrapper, rel=None + ) + + export_cuds(sampleSRM[0], file=os.path.join( + dir_path, "twc_thermal_all.ttl"), format="ttl") + + export_cuds(output_data[1], file=os.path.join( + dir_path, "twc_thermal_out.ttl"), format="ttl") + + logger.info("################ End: TWC thermal model ################") + + return output_data + + +if __name__ == "__main__": + evaluate_example() diff --git a/examples/evaluate.py b/examples/evaluate.py index e2415f2..1d61744 100644 --- a/examples/evaluate.py +++ b/examples/evaluate.py @@ -13,7 +13,7 @@ ) -def evaluate_example(surrogateToLoad="mods-sim-8606989784878733752"): +def evaluate_example(surrogateToLoad="example-surrogate"): logger.info( "################ Start: MoDS Evaluate Surrogate Example ################") logger.info("Loading enviroment variables") diff --git a/examples/hdmr.py b/examples/hdmr.py index e26d37d..df3bfcb 100644 --- a/examples/hdmr.py +++ b/examples/hdmr.py @@ -67,8 +67,15 @@ def HDMR_example(): job_id = search.find_cuds_objects_by_oclass( mods.JobID, wrapper, rel=None ) + + sim = search.find_cuds_objects_by_oclass( + mods.Simulation, wrapper, rel=None + ) logger.info("Printing the simulation results.") + + if sim: + pretty_print(sim[0]) if job_id: pretty_print(job_id[0]) diff --git a/mods.ttl b/mods.ttl index b40b702..27881cc 100644 --- a/mods.ttl +++ b/mods.ttl @@ -1,201 +1,407 @@ -@prefix ns1: . -@prefix ns2: . +@prefix ns1: . @prefix owl: . @prefix rdfs: . +@prefix skos: . @prefix xsd: . - ns2:_default_rel . + ns1:_default_rel . a owl:Class ; + ns1:_default [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ] ; rdfs:subClassOf [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], + owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], + owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], + owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], - ns2:Entity ; - ns1:prefLabel "Algorithm"@en . + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "Algorithm"@en . a owl:Class ; - rdfs:subClassOf ns2:Entity ; - ns1:prefLabel "AnalyticModel"@en . + rdfs:subClassOf ns1:Entity ; + skos:prefLabel "AnalyticModel"@en . a owl:Class ; - rdfs:subClassOf ns2:Entity ; - ns1:prefLabel "DataPoint"@en . + rdfs:subClassOf ns1:Entity ; + skos:prefLabel "DataPoint"@en . - a owl:Class ; + a owl:Class ; + rdfs:subClassOf ; + skos:prefLabel "EvaluateSurrogate"@en . + + a owl:Class ; rdfs:subClassOf [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], - [ a owl:Restriction ; - owl:cardinality 1 ; - owl:onProperty ], - ns2:Entity ; - ns1:prefLabel "DataPointItem"@en . + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "File"@en . a owl:Class ; rdfs:subClassOf [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], + owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], - ns2:Entity ; - ns1:prefLabel "Function"@en . + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "Function"@en . a owl:Class ; rdfs:subClassOf ; - ns1:prefLabel "HighDimensionalModelRepresentationSimulation"@en . + skos:prefLabel "HighDimensionalModelRepresentationSimulation"@en . + + a owl:Class ; + rdfs:subClassOf [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "InitialReadDetail"@en . a owl:Class ; rdfs:subClassOf ; - ns1:prefLabel "InputData"@en . + skos:prefLabel "InputData"@en . a owl:Class ; - rdfs:subClassOf ns2:Entity ; - ns1:prefLabel "JobID"@en . + rdfs:subClassOf ns1:Entity ; + skos:prefLabel "JobID"@en . a owl:Class ; rdfs:subClassOf [ a owl:Restriction ; owl:cardinality 1 ; owl:onProperty ], - ns2:Entity ; - ns1:prefLabel "JobIDItem"@en . + ns1:Entity ; + skos:prefLabel "JobIDItem"@en . + + a owl:Class ; + rdfs:subClassOf [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "ModelInput"@en . a owl:Class ; rdfs:subClassOf ; - ns1:prefLabel "MultiObjectiveSimulation"@en . + skos:prefLabel "MultiObjectiveSimulation"@en . a owl:Class ; rdfs:subClassOf ; - ns1:prefLabel "MultiObjectiveSimulationOnly"@en . + skos:prefLabel "MultiObjectiveSimulationOnly"@en . a owl:Class ; - rdfs:subClassOf ; - ns1:prefLabel "ParetoFront"@en . + rdfs:subClassOf ; + skos:prefLabel "ParetoFront"@en . + + a owl:Class ; + rdfs:subClassOf ; + skos:prefLabel "SampleSRM"@en . + + a owl:Class ; + rdfs:subClassOf [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "Sensitivity"@en . + + a owl:Class ; + rdfs:subClassOf ; + skos:prefLabel "SensitivityAnalysis"@en . + + a owl:Class ; + rdfs:subClassOf ; + skos:prefLabel "SensitivityDataSet"@en . + + a owl:Class ; + rdfs:subClassOf [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + ; + skos:prefLabel "SensitivityItem"@en . a owl:Class ; - ns2:_default [ ns2:_default_attribute ; - ns2:_default_value "None" ], - [ ns2:_default_attribute ; - ns2:_default_value "None" ], - [ ns2:_default_attribute ; - ns2:_default_value "None" ], - [ ns2:_default_attribute ; - ns2:_default_value "None" ] ; + ns1:_default [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ], + [ ns1:_default_attribute ; + ns1:_default_value "None" ] ; rdfs:subClassOf [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "Variable"@en . + + a owl:Class ; + rdfs:subClassOf [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], [ a owl:Restriction ; + owl:cardinality 1 ; + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "WorkingReadDetail"@en . + + a owl:Class ; + rdfs:subClassOf [ a owl:Restriction ; owl:cardinality 1 ; owl:onProperty ], [ a owl:Restriction ; owl:cardinality 1 ; - owl:onProperty ], - ns2:Entity ; - ns1:prefLabel "Variable"@en . + owl:onProperty ], + ns1:Entity ; + skos:prefLabel "DataPointItem"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "formula"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "formula"@en . + + a owl:ObjectProperty ; + rdfs:isDefinedBy "links output to input"@en ; + rdfs:subPropertyOf ns1:activeRelationship ; + owl:inverseOf ; + skos:prefLabel "isDerivedFrom"@en . a owl:ObjectProperty ; rdfs:isDefinedBy "inverse of the default relationship"@en ; - rdfs:subPropertyOf ns2:passiveRelationship ; + rdfs:subPropertyOf ns1:passiveRelationship ; owl:inverseOf ; - ns1:prefLabel "isPartOf"@en . + skos:prefLabel "isPartOf"@en . - a owl:DatatypeProperty, + a owl:ObjectProperty ; + rdfs:isDefinedBy "links input to output"@en ; + rdfs:subPropertyOf ns1:passiveRelationship ; + owl:inverseOf ; + skos:prefLabel "isSourceOf"@en . + + a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "surrogateToLoad"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "lb_append"@en . - a owl:DatatypeProperty, + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "lb_factor"@en . + + a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:integer ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "maxNumberOfResults"@en . + rdfs:subPropertyOf ; + skos:prefLabel "order"@en . - a owl:DatatypeProperty, + a owl:DatatypeProperty, owl:FunctionalProperty ; - rdfs:range xsd:boolean ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "saveSurrogate"@en . + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "ub_append"@en . - a owl:DatatypeProperty, + a owl:DatatypeProperty, owl:FunctionalProperty ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "value"@en . + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "ub_factor"@en . a owl:Class ; - rdfs:subClassOf ns2:Entity ; - ns1:prefLabel "DataSet"@en . + rdfs:subClassOf ns1:Entity ; + skos:prefLabel "DataSet"@en . + + a owl:Class ; + rdfs:subClassOf ; + skos:prefLabel "OutputData"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "file"@en . a owl:ObjectProperty ; rdfs:isDefinedBy "default relationship"@en ; - rdfs:subPropertyOf ns2:activeRelationship ; + rdfs:subPropertyOf ns1:activeRelationship ; owl:inverseOf ; - ns1:prefLabel "hasPart"@en . + skos:prefLabel "hasPart"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "maxNumberOfResults"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "maximum"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "maximum"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "minimum"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "minimum"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "modelToLoad"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "nParams"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "objective"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "objective"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "read_function"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:boolean ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "saveSurrogate"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "surrogateToLoad"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "type"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "type"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "value"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "weight"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "weight"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "x_column"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "x_value"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "y_column"@en . + + a owl:DatatypeProperty, + owl:FunctionalProperty ; + rdfs:range xsd:string ; + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "path"@en . a owl:Class ; - rdfs:subClassOf ns2:Entity ; - ns1:prefLabel "Simulation"@en . + rdfs:subClassOf ns1:Entity ; + skos:prefLabel "Simulation"@en . a owl:DatatypeProperty, owl:FunctionalProperty ; rdfs:range xsd:string ; - rdfs:subPropertyOf ns2:attribute ; - ns1:prefLabel "name"@en . + rdfs:subPropertyOf ns1:attribute ; + skos:prefLabel "name"@en . diff --git a/ontology.mods.yml b/ontology.mods.yml index dc039ae..3a66caa 100644 --- a/ontology.mods.yml +++ b/ontology.mods.yml @@ -17,6 +17,18 @@ ontology: inverse: mods.hasPart subclass_of: - cuba.passiveRelationship + + isDerivedFrom: + description: "links output to input" + inverse: mods.isSourceOf + subclass_of: + - cuba.activeRelationship + + isSourceOf: + description: "links input to output" + inverse: mods.isDerivedFrom + subclass_of: + - cuba.passiveRelationship ################ MAIN ENTITIES ################ #================================================# @@ -67,6 +79,19 @@ ontology: - mods.hasPart: cardinality: 1 range: mods.OutputData + - mods.hasPart: + cardinality: some + range: mods.ModelInput + + SampleSRM: + subclass_of: + - mods.Simulation + - mods.hasPart: + cardinality: 1 + range: mods.OutputData + - mods.hasPart: + cardinality: 1 + range: mods.File SensitivityAnalysis: subclass_of: @@ -87,6 +112,7 @@ ontology: mods.maxNumberOfResults: None mods.saveSurrogate: None mods.surrogateToLoad: None + mods.modelToLoad: None InputData: subclass_of: @@ -102,6 +128,21 @@ ontology: OutputData: subclass_of: - mods.DataSet + + ModelInput: + subclass_of: + - cuba.Entity + - mods.hasPart: + cardinality: 1 + range: mods.DataSet + attributes: + mods.path: + + File: + subclass_of: + - cuba.Entity + attributes: + mods.file: ParetoFront: subclass_of: @@ -136,6 +177,9 @@ ontology: - mods.hasPart: cardinality: some range: mods.DataPointItem + - mods.isDerivedFrom: + cardinality: some + range: mods.DataPoint DataPointItem: subclass_of: @@ -182,10 +226,35 @@ ontology: attributes: mods.name: mods.type: + mods.path: None mods.objective: None mods.minimum: None mods.maximum: None mods.weight: None + mods.nParams: None + + InitialReadDetail: + subclass_of: + - cuba.Entity + attributes: + mods.file: + mods.x_column: + mods.y_column: + mods.x_value: + mods.read_function: + mods.lb_factor: + mods.ub_factor: + mods.lb_append: + mods.ub_append: + + WorkingReadDetail: + subclass_of: + - cuba.Entity + attributes: + mods.x_column: + mods.y_column: + mods.x_value: + mods.read_function: formula: subclass_of: @@ -210,11 +279,21 @@ ontology: subclass_of: - cuba.attribute datatype: STRING + + file: + subclass_of: + - cuba.attribute + datatype: STRING type: subclass_of: - cuba.attribute datatype: STRING + + path: + subclass_of: + - cuba.attribute + datatype: STRING saveSurrogate: subclass_of: @@ -225,6 +304,11 @@ ontology: subclass_of: - cuba.attribute datatype: STRING + + modelToLoad: + subclass_of: + - cuba.attribute + datatype: STRING objective: subclass_of: @@ -245,8 +329,53 @@ ontology: subclass_of: - cuba.attribute datatype: STRING + + nParams: + subclass_of: + - cuba.attribute + datatype: STRING maxNumberOfResults: subclass_of: - cuba.attribute datatype: STRING + + x_column: + subclass_of: + - cuba.attribute + datatype: STRING + + y_column: + subclass_of: + - cuba.attribute + datatype: STRING + + x_value: + subclass_of: + - cuba.attribute + datatype: STRING + + read_function: + subclass_of: + - cuba.attribute + datatype: STRING + + lb_factor: + subclass_of: + - cuba.attribute + datatype: STRING + + ub_factor: + subclass_of: + - cuba.attribute + datatype: STRING + + lb_append: + subclass_of: + - cuba.attribute + datatype: STRING + + ub_append: + subclass_of: + - cuba.attribute + datatype: STRING diff --git a/osp/wrappers/sim_cmcl_mods_wrapper/agent_bridge.py b/osp/wrappers/sim_cmcl_mods_wrapper/agent_bridge.py index 578a2aa..40b08f6 100644 --- a/osp/wrappers/sim_cmcl_mods_wrapper/agent_bridge.py +++ b/osp/wrappers/sim_cmcl_mods_wrapper/agent_bridge.py @@ -5,6 +5,7 @@ from typing import Optional, Dict import logging import os +import io logger = logging.getLogger(__name__) @@ -15,10 +16,10 @@ class Agent_Bridge: """ # Polling interval when waiting or jobs to finish (seconds) - POLL_INTERVAL: int = 10 + POLL_INTERVAL: int = 5 # Maximum number of requests when waiting for jobs to finish - MAX_ATTEMPTS: int = 60 + MAX_ATTEMPTS: int = 120 # Additional URL part for job submission SUBMISSION_URL_PART: str = "request?query=" @@ -45,8 +46,8 @@ def runJob(self, jsonString: str) -> Optional[Dict]: Resulting JSON data objects (or None if error occurs) """ os.environ['NO_PROXY'] = self.base_url - logger.info("MoDS enpoint: %s", os.environ['MODS_AGENT_BASE_URL']) - + logger.info(f"MoDS endpoint: {os.environ['MODS_AGENT_BASE_URL']}") + logger.info("Submitting job") logger.debug("Submission JSON: \n%s", jsonString) submit_message = self.submitJob(jsonString) @@ -95,7 +96,12 @@ def submitJob(self, jsonString: str) -> dict: logger.debug("Submission URL: %s", url) # Submit the request and get the response - response = requests.get(url) + # If the URL is long, submit request with a JSON file + if len(url)<1000: + response = requests.get(url) + else: + my_file = io.BytesIO(json.dumps(json.loads(jsonString),indent=2).encode()) + response = requests.post(self.base_url+"filerequest",files={"file":my_file}) # Check the HTTP return code if (response.status_code != 200): diff --git a/osp/wrappers/sim_cmcl_mods_wrapper/cuds_adaptor.py b/osp/wrappers/sim_cmcl_mods_wrapper/cuds_adaptor.py index 32a62f1..1dbec79 100644 --- a/osp/wrappers/sim_cmcl_mods_wrapper/cuds_adaptor.py +++ b/osp/wrappers/sim_cmcl_mods_wrapper/cuds_adaptor.py @@ -19,7 +19,8 @@ SIM_TYPE_KEY = "SimulationType" SAVE_SURROGATE_KEY = "saveSurrogate" SURROGATE_TO_LOAD_KEY = "surrogateToLoad" -OPTIONAL_ATTRS = ["objective", "maximum", "minimum", "weight"] +OPTIONAL_ATTRS = ["objective", "maximum", + "minimum", "weight", "path", "nParams"] class CUDS_Adaptor: @@ -42,7 +43,8 @@ def toJSON(root_cuds_object: Cuds, simulation_template: Enum) -> str: engtempl.Engine_Template.HDMR, engtempl.Engine_Template.Evaluate, engtempl.Engine_Template.Sensitivity, - engtempl.Engine_Template.MCDM}: + engtempl.Engine_Template.MCDM, + engtempl.Engine_Template.SampleSRM}: logger.info("Registering inputs") jsonData[SIM_TYPE_KEY] = simulation_template.name @@ -57,10 +59,19 @@ def toJSON(root_cuds_object: Cuds, simulation_template: Enum) -> str: jsonData=jsonData, ) - CUDS_Adaptor.inputAnalyticModelCUDStoJSON( - root_cuds_object=root_cuds_object, - jsonData=jsonData, - ) + if simulation_template == engtempl.Engine_Template.SampleSRM: + CUDS_Adaptor.outputDataCUDStoJSON( + root_cuds_object=root_cuds_object, + jsonData=jsonData, + ) + CUDS_Adaptor.FilesCUDStoJSON( + root_cuds_object=root_cuds_object, + jsonData=jsonData, + ) + CUDS_Adaptor.ModelInputsCUDStoJSON( + root_cuds_object=root_cuds_object, + jsonData=jsonData, + ) jsonDataStr = json.dumps(jsonData) return jsonDataStr @@ -87,6 +98,7 @@ def algorithmsCUDStoJSON(root_cuds_object, jsonData): json_item['maxNumberOfResults'] = algorithm.maxNumberOfResults if algorithm.maxNumberOfResults != "None" else None json_item['saveSurrogate'] = algorithm.saveSurrogate if algorithm.saveSurrogate != "None" else None json_item['surrogateToLoad'] = algorithm.surrogateToLoad if algorithm.surrogateToLoad != "None" else None + json_item['modelToLoad'] = algorithm.modelToLoad if algorithm.modelToLoad != "None" else None variables = algorithm.get(oclass=mods.Variable) @@ -100,6 +112,29 @@ def algorithmsCUDStoJSON(root_cuds_object, jsonData): opt_attr_value = getattr(var_item, opt_attr, "None") if opt_attr_value != "None": variables[opt_attr] = opt_attr_value + initialreaddetail = var_item.get( + oclass=mods.InitialReadDetail) + if initialreaddetail: + variables["initialReadDetail"] = { + "x_column": initialreaddetail[0].x_column, + "y_column": initialreaddetail[0].y_column, + "x_value": initialreaddetail[0].x_value, + "read_function": initialreaddetail[0].read_function, + "file_name": initialreaddetail[0].file, + "lb_factor": initialreaddetail[0].lb_factor, + "ub_factor": initialreaddetail[0].ub_factor, + "lb_append": initialreaddetail[0].lb_append, + "ub_append": initialreaddetail[0].ub_append + } + workingreaddetail = var_item.get( + oclass=mods.WorkingReadDetail) + if workingreaddetail: + variables["workingReadDetail"] = { + "x_column": workingreaddetail[0].x_column, + "y_column": workingreaddetail[0].y_column, + "x_value": workingreaddetail[0].x_value, + "read_function": workingreaddetail[0].read_function + } json_item['variables'].append(variables) elif json_item['surrogateToLoad'] is None: raise ValueError( @@ -113,14 +148,17 @@ def algorithmsCUDStoJSON(root_cuds_object, jsonData): @staticmethod def inputDataCUDStoJSON(root_cuds_object, jsonData): + inputData: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.InputData, root_cuds_object, rel=None + ) # type: ignore dataPoints: List[Cuds] = search.find_cuds_objects_by_oclass( - mods.DataPoint, root_cuds_object, rel=None + mods.DataPoint, inputData[0], rel=mods.hasPart ) # type: ignore surrogateToLoad: List[Cuds] = search.find_cuds_objects_by_oclass( mods.Algorithm, root_cuds_object, rel=None )[0].surrogateToLoad # type: ignore - logger.info("Registering simulation data points.") + logger.info("Registering input simulation data points.") if not dataPoints and not surrogateToLoad: raise ValueError( ( @@ -147,6 +185,100 @@ def inputDataCUDStoJSON(root_cuds_object, jsonData): for name, values in json_items.items(): jsonData[INPUTS_KEY].append({'name': name, 'values': values}) + @staticmethod + def outputDataCUDStoJSON(root_cuds_object, jsonData): + outputData: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.OutputData, root_cuds_object, rel=None + ) # type: ignore + dataPoints: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.DataPoint, outputData[0], rel=mods.hasPart + ) # type: ignore + surrogateToLoad: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.Algorithm, root_cuds_object, rel=None + )[0].surrogateToLoad # type: ignore + + logger.info("Registering output simulation data points.") + if not dataPoints and not surrogateToLoad: + raise ValueError( + ( + "Missing DataPoint specification. " + "At least one DataPoint CUDS must be defined or a surrogate must be loaded." + ) + ) + + json_items = defaultdict(list) + for datum in dataPoints: + datum_items = datum.get(oclass=mods.DataPointItem) + if not datum_items: + raise ValueError( + ( + "Missing DataPointItem specification. " + "At least one DataPointItem CUDS must be " + "defined for each DataPoint." + ) + ) + + for dat_item in datum_items: # type: ignore + json_items[dat_item.name].append(dat_item.value) + + for name, values in json_items.items(): + jsonData[OUTPUTS_KEY].append({'name': name, 'values': values}) + + @staticmethod + def FilesCUDStoJSON(root_cuds_object, jsonData): + Files: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.File, root_cuds_object, rel=None + ) + if not Files: + raise ValueError( + ( + "Missing Files specification." + ) + ) + jsonData["Files"] = [f.file for f in Files] + + @staticmethod + def ModelInputsCUDStoJSON(root_cuds_object, jsonData): + modelInputs: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.ModelInput, root_cuds_object, rel=None + ) # type: ignore + if not modelInputs: + raise ValueError( + ( + "Missing ModelInput specification." + ) + ) + + for modelInput in modelInputs: + datasets: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.DataSet, modelInput, rel=mods.hasPart + ) + + dataPoints: List[Cuds] = search.find_cuds_objects_by_oclass( + mods.DataPoint, datasets[0], rel=mods.hasPart + ) + + json_items = defaultdict(list) + for datum in dataPoints: + datum_items = datum.get(oclass=mods.DataPointItem) + if not datum_items: + raise ValueError( + ( + "Missing DataPointItem specification. " + "At least one DataPointItem CUDS must be " + "defined for each DataPoint." + ) + ) + + for dat_item in datum_items: # type: ignore + json_items[dat_item.name].append(dat_item.value) + data = [] + + for name, values in json_items.items(): + data.append({'name': name, 'values': values}) + jsonData["ModelInputs"].append( + {'path': modelInput.path, 'data': data}) + @staticmethod def inputAnalyticModelCUDStoJSON(root_cuds_object, jsonData): analyticModels: List[Cuds] = search.find_cuds_objects_by_oclass( @@ -200,6 +332,41 @@ def toCUDS( elif simulation_template == engtempl.Engine_Template.Evaluate: output_data = mods.OutputData() + input_data = simulation.get( + oclass=mods.InputData, rel=None)[0] + + input_data_points = input_data.get( + oclass=mods.DataPoint, rel=mods.hasPart) + + num_values = len(jsonResults[OUTPUTS_KEY][0]["values"]) + for i in range(num_values): + data_point = mods.DataPoint() + for output in jsonResults[OUTPUTS_KEY]: + out_value = output["values"][i] + out_name = output["name"] + + data_point.add( + mods.DataPointItem(name=out_name, value=out_value), + rel=mods.hasPart, + ) + + data_point.add( + input_data_points[i], + rel=mods.isDerivedFrom, + ) + + output_data.add( + data_point, + rel=mods.hasPart, + ) + + simulation.add(output_data) + + elif simulation_template == engtempl.Engine_Template.SampleSRM: + output_data = mods.OutputData() + simulation = root_cuds_object.get( + oclass=mods.SampleSRM, rel=cuba.relationship)[0] + num_values = len(jsonResults[OUTPUTS_KEY][0]["values"]) for i in range(num_values): data_point = mods.DataPoint() diff --git a/osp/wrappers/sim_cmcl_mods_wrapper/engine_exceptions.py b/osp/wrappers/sim_cmcl_mods_wrapper/engine_exceptions.py index def9697..2477461 100644 --- a/osp/wrappers/sim_cmcl_mods_wrapper/engine_exceptions.py +++ b/osp/wrappers/sim_cmcl_mods_wrapper/engine_exceptions.py @@ -1,3 +1,3 @@ class UnsupportedSimulationType(Exception): """Requested simulation is not supported by the engine""" - pass \ No newline at end of file + pass diff --git a/osp/wrappers/sim_cmcl_mods_wrapper/engine_sim_templates.py b/osp/wrappers/sim_cmcl_mods_wrapper/engine_sim_templates.py index e84fdae..1386760 100644 --- a/osp/wrappers/sim_cmcl_mods_wrapper/engine_sim_templates.py +++ b/osp/wrappers/sim_cmcl_mods_wrapper/engine_sim_templates.py @@ -8,3 +8,4 @@ class Engine_Template(Enum): Evaluate = 4 Sensitivity = 5 MCDM = 6 + SampleSRM = 7 diff --git a/osp/wrappers/sim_cmcl_mods_wrapper/mods_engine.py b/osp/wrappers/sim_cmcl_mods_wrapper/mods_engine.py index 6aaa3a4..6685e35 100644 --- a/osp/wrappers/sim_cmcl_mods_wrapper/mods_engine.py +++ b/osp/wrappers/sim_cmcl_mods_wrapper/mods_engine.py @@ -10,6 +10,7 @@ logger = logging.getLogger(__name__) + class MoDS_Engine: """Engine handling data objects for the MoDS use cases.""" @@ -43,6 +44,10 @@ def determineTemplate(self, root_cuds_object: Cuds) -> None: simulation_class = simulation_list[0].oclass + samplesrm_class = search.find_cuds_objects_by_oclass( + mods.SampleSRM, root_cuds_object, rel=None + ) # type: ignore + if simulation_class == mods.MultiObjectiveSimulation: self.simulation_template = engtempl.Engine_Template.MOO elif simulation_class == mods.MultiObjectiveSimulationOnly: @@ -55,6 +60,8 @@ def determineTemplate(self, root_cuds_object: Cuds) -> None: self.simulation_template = engtempl.Engine_Template.Sensitivity elif simulation_class == mods.MultiCriteriaDecisionMaking: self.simulation_template = engtempl.Engine_Template.MCDM + elif samplesrm_class: + self.simulation_template = engtempl.Engine_Template.SampleSRM else: raise enexc.UnsupportedSimulationType @@ -67,7 +74,8 @@ def generateJSON(self, root_cuds_object: Cuds) -> str: self.executed = False # Build the JSON data from the CUDS objects - jsonSimCase = CUDS_Adaptor.toJSON(root_cuds_object, self.simulation_template) + jsonSimCase = CUDS_Adaptor.toJSON( + root_cuds_object, self.simulation_template) logger.info("JSON data successfully generated from CUDS objects.") return jsonSimCase @@ -76,8 +84,10 @@ def parseResults(self, root_cuds_object, jsonResults: Dict) -> None: function parses them in to CUDS objects.""" # Use the CUDS_Adaptor to fill CUDS objects with results - CUDS_Adaptor.toCUDS(root_cuds_object, jsonResults, self.simulation_template) - logger.info("CUDS objects have now been populated with simulation results.") + CUDS_Adaptor.toCUDS(root_cuds_object, jsonResults, + self.simulation_template) + logger.info( + "CUDS objects have now been populated with simulation results.") self.successful = True def hasExecuted(self) -> bool: