ahuora-builder 0.1.0__py3-none-any.whl

ahuora_builder/tests/test_solver/test_solve_models.py

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+import os
+import json
+import io
+
+from typing import Any
+
+from ahuora_builder_types import FlowsheetSchema
+from ahuora_builder_types.payloads import BuildStateRequestSchema
+from ahuora_builder.flowsheet_manager import FlowsheetManager
+from ahuora_builder.build_state import solve_state_block
+from contextlib import redirect_stdout
+
+
+# Set this to True to regenerate expected output files, if needed (e.g output file format changes.)
+# Make sure to review the commit to ensure that only intended changes are made to expected output files.
+GENERATE_TESTS = False
+
+# Get current location (so that we can retrieve pump.json)
+__location__ = os.path.realpath(os.path.join(os.getcwd(), os.path.dirname(__file__)))
+
+
+def try_solve(input_file: str, expected_output_file: str, state_block=False) -> None:
+    """Tests that the model can be solved and that the answer returned is correct"""
+
+    with open(os.path.join(__location__, input_file), 'r') as file:
+
+        data = json.load(file)
+
+        if state_block:
+            build_state_schema = BuildStateRequestSchema.model_validate(data)
+            result = solve_state_block(build_state_schema)
+            result = [solved_value.model_dump() for solved_value in result]
+        else:
+            flowsheet_schema = FlowsheetSchema.model_validate(data)
+            flowsheet = FlowsheetManager(flowsheet_schema)
+            flowsheet.load()
+            flowsheet.initialise()
+            assert flowsheet.degrees_of_freedom() == 0, "Degrees of freedom is not 0: " + str(flowsheet.degrees_of_freedom())
+            flowsheet.report_statistics()
+            flowsheet.solve()
+            flowsheet.optimize()
+
+            result = flowsheet.serialise()
+            result = result.model_dump()
+
+            # ignore initial values
+            del result["initial_values"]
+
+        # # write result to a file for debugging - or to regenerate expected files
+        if GENERATE_TESTS:
+            with open(os.path.join(__location__, expected_output_file), 'w') as f:
+                f.write(json.dumps(result, indent=4))
+
+        print(result)
+
+        # Assert - Check if all the parameters are correct
+        with open(os.path.join(__location__, expected_output_file), 'r') as file:
+            # Load the result JSON file
+            expected_result = json.load(file)
+
+            # Check if the result is equal to the expected_result
+            try:
+                if state_block:
+                 values_approximately_equal(result, expected_result, 1e-1)
+                else:
+                    values_approximately_equal(result, expected_result, 1e-1)
+            except Exception as e:
+                print(e)
+                raise AssertionError(f"Did not solve the model correctly")
+
+
+def values_approximately_equal(val1: Any, val2: Any, tolerance: float = 1e-3) -> bool:
+    """
+    Checks if two values are approximately equal
+    """
+    if isinstance(val1, (float, int)) and isinstance(val2, (float, int)):
+        if not abs(val1 - val2) < tolerance:
+            raise AssertionError(f"Value: {val1} is not equal to expected value: {val2} within tolerance {tolerance}")
+    elif isinstance(val1, list) and isinstance(val2, list):
+        if len(val1) != len(val2):
+            raise AssertionError(f"Lists have different lengths: {len(val1)} and {len(val2)}")
+        return all(values_approximately_equal(v1, v2, tolerance) for v1, v2 in zip(val1, val2))
+    elif isinstance(val1, dict) and isinstance(val2, dict):
+        if set(val1.keys()) != set(val2.keys()):
+            raise AssertionError(f"Keys: {val1.keys()} are not equal to expected keys: {val2.keys()}")
+        return all(values_approximately_equal(val1[key], val2[key], tolerance) for key in val1)
+    else:
+        if val1 != val2:
+            raise AssertionError(f"Value: {val1} is not equal to expected value: {val2}")
+    return True
+
+
+def test_generate_is_false():
+    assert GENERATE_TESTS is False, "test_generate_python_file.py:  GENERATE_TESTS should be False to avoid overriding test_solved.json files during tests."
+
+
+def test_solve_pump_and_heater() -> None:
+    # Tests that the pump and heater model can be solved 
+    try_solve('configurations/pump.json', 'configurations/pump_solved.json')
+
+
+def test_solve_recycle() -> None:
+    # Tests that the recycle model can be solved (Recycle connected to itself)
+    try_solve('configurations/recycle.json', 'configurations/recycle_solved.json')
+
+
+def test_solve_compressor() -> None:
+    # Tests that the compressor model can be solved
+    try_solve('configurations/compressor.json', 'configurations/compressor_solved.json')
+
+
+def test_solve_mixer() -> None:
+    # Tests that the mixer model can be solved
+    try_solve('configurations/mixer.json', 'configurations/mixer_solved.json')
+
+
+def test_solve_bt_pr() -> None:
+    # Peng-Robinson test with Benzene and Toluene
+    try_solve('configurations/BT_PR.json', 'configurations/BT_PR_solved.json')
+
+
+def test_solve_heat_exchanger() -> None:
+    """Tests that the BT_PR model can be solved"""
+    try_solve('configurations/heat_exchanger.json','configurations/heat_exchanger_solved.json')
+
+
+def test_solve_heat_pump() -> None:
+    """Tests that the turbine model can be solved"""
+    # TODO: fix this test case - the values specified are not very good
+    # and although the model solves, it doesn't really show anything useful
+    try_solve('configurations/heat_pump.json','configurations/heat_pump_solved.json')
+
+
+def test_solve_unit_conversions() -> None:
+    """
+    Checks that unit conversions work as expected
+
+    To do this, we solve the pump model and check that everything works as expected
+    """
+    # the output file should stay the same since we are just changing the units
+    try_solve('configurations/pump_unit_conversions.json', 'configurations/pump_solved.json')
+
+
+def test_solve_expressions() -> None:
+    """
+    Checks that expressions work as expected
+    """
+    try_solve('configurations/expressions.json', 'configurations/expressions_solved.json')
+
+
+def test_solve_vapor_frac_target():
+    # compressor_test_with_vapor_fraction - targets an outlet vapor fraction of 1
+    try_solve('configurations/vapor_frac_target.json', 'configurations/vapor_frac_target_solved.json')
+
+
+def test_solve_mass_flow_tear():
+    # recycle with mass flow constraint
+    try_solve('configurations/mass_flow_tear.json', 'configurations/mass_flow_tear_solved.json')
+
+
+def test_solve_propane_recycle():
+    try_solve('configurations/propane_recycle.json', 'configurations/propane_recycle_solved.json')
+
+
+def test_solve_propane_heat_pump():
+    try_solve('configurations/propane_heat_pump.json', 'configurations/propane_heat_pump_solved.json')
+
+
+def test_solve_control():
+    # inlet enthalpy is controlled by the set point of the outlet enthalpy
+    try_solve('configurations/control.json', 'configurations/control_solved.json')
+    
+def test_solve_machine_learning():
+    try_solve('configurations/machine_learning.json', 'configurations/machine_learning_solved.json')
+
+
+def test_solve_sb_vapor_frac() -> None:
+    # Tests that a state block with vapor_frac can be solved
+    try_solve('configurations/sb_vapor_frac.json', 'configurations/sb_vapor_frac_solved.json', state_block=True)
+
+
+def test_solve_compound_separator() -> None:
+    # Tests that a compound separator model can be solved
+    try_solve('configurations/compound_separator.json', 'configurations/compound_separator_solved.json')
+
+
+def test_solve_constraints() -> None:
+    # Tests that a model with constraints can be solved
+    # Tests for an equality constraint using an expression
+    try_solve('configurations/constraints.json', 'configurations/constraints_solved.json')
+
+
+def test_solve_link() -> None:
+    # Tests that a bus model can be solved
+    try_solve('configurations/bus.json', 'configurations/bus_solved.json')
+
+
+def test_solve_optimization() -> None:
+    # Tests optimizing an expression
+    try_solve('configurations/optimization.json', 'configurations/optimization_solved.json')
+
+def test_solve_solar() -> None:
+    # Tests that a solar model can be solved  
+    try_solve('configurations/solar.json', 'configurations/solar_solved.json') 
+
+
+def test_solve_milk_heater() -> None:
+    try_solve('configurations/milk_heater.json', 'configurations/milk_heater_solved.json') 
+
+def test_solve_dynamic_tank() -> None:
+    try_solve('configurations/dynamic_tank.json', 'configurations/dynamic_tank_solved.json') 
+
+def test_solve_elimination() -> None:
+    # more complex elimination, where there are choices to eliminate and the right pair has to be eliminated
+    # ie. because we can't have both enthalpy and temperature fixed at the same time, leaving
+    # both flow_mol and flow_mass unfixed (even this is still the correct degrees of freedom)
+    # in this specific test case, flow_mass should eliminate flow_mol and constrain at the state block level
+    try_solve('configurations/elimination.json', 'configurations/elimination_solved.json')
+
+def test_solve_header() -> None:
+    # Tests that a compound separator model can be solved
+    try_solve('configurations/header.json', 'configurations/header_solved.json')
+
+def test_initialisation_disabled_branch():
+    """
+    Test that FlowsheetManager.initialise() skips initialisation and prints the correct message
+    when disable_initialization is True.
+    """
+    schema = FlowsheetSchema(
+        id=999,
+        dynamic=False,
+        time_set=[0],
+        property_packages=[],
+        unit_models=[],
+        arcs=[],
+        expressions=[],
+        optimizations=[],
+        is_rating_mode=False,
+        disable_initialization=True,  # Disable initialisation for this test
+    )
+    manager = FlowsheetManager(schema)
+    manager.load()
+
+    f = io.StringIO()
+    with redirect_stdout(f):
+        manager.initialise()
+    output = f.getvalue()
+
+    assert "Initialisation is disabled for this scenario." in output
+    assert "initialise_model" not in output

ahuora_builder/timing.py

@@ -0,0 +1,65 @@
+from contextvars import ContextVar
+import time
+
+
+class TimingDebugHandler:
+    def __init__(self, key: str = "root") -> None:
+        self.timing: dict[str, dict] = {}
+        self.pointer_stack = [self.timing]
+        self.step_into(key)
+    
+    def current_item(self):
+        item = self.current_pointer()
+        if len(item) == 0:
+            return None
+        return item[list(item.keys())[-1]]
+    
+    def current_pointer(self):
+        return self.pointer_stack[-1]
+    
+    def update_last_timing(self):
+        if self.current_item():
+            # update the duration of the previous key
+            self.current_item()["duration"] = time.time() - self.current_item()["start_time"]
+
+    def add_timing(self, key: str):
+        self.update_last_timing()
+        self.current_pointer()[key] = {
+            "start_time": time.time(),
+            "duration": None,  # calculated at the next timing
+            "children": {}
+        }
+    
+    def step_into(self, key=None):
+        self.add_timing(key)
+        self.pointer_stack.append(self.current_item()["children"])
+    
+    def step_out(self):
+        self.update_last_timing()
+        self.pointer_stack.pop()
+
+    def close(self):
+        # update root duration
+        self.step_out()
+        self.update_last_timing()
+        return self.timing
+
+
+def start_timing(key: str = "root"):
+    """
+    start a new timing handler
+    """
+    handler = TimingDebugHandler(key)
+    timing.set(handler)
+    return handler
+
+
+def get_timer():
+    """
+    get the current timing handler
+    """
+    return timing.get()
+
+
+# Create a context variable to store the timing information
+timing: ContextVar[TimingDebugHandler | None] = ContextVar("timing", default=None)

ahuora_builder/types/__init__.py

@@ -0,0 +1 @@
+

ahuora_builder/unit_model_manager.py

@@ -0,0 +1,48 @@
+from .methods.load_unit_model import add_unit_model_to_flowsheet
+from .methods.adapter_library import UnitModelConstructor, AdapterLibrary
+from .flowsheet_manager_type import FlowsheetManager
+from ahuora_builder_types import UnitModelId, UnitModelSchema
+from idaes.core import UnitModelBlock
+
+
+
+class UnitModelManager:
+    """
+    Manages the unit models in the flowsheet
+    """
+
+    def __init__(self, flowsheet_manager: FlowsheetManager) -> None:
+        """
+        Create a new unit model manager
+        """
+        self.flowsheet_manager = flowsheet_manager
+        self._unit_models: dict[UnitModelId, UnitModelBlock] = {}
+
+    def load(self) -> None:
+        """
+        load all unit models from the schema into the flowsheet
+        """
+        schema = self.flowsheet_manager.schema
+
+        for unit_model_def in schema.unit_models:
+            unit_model_type = unit_model_def.type
+            if unit_model_type not in AdapterLibrary:
+                raise Exception(
+                    f"Unit model type '{unit_model_type}' is not in the adapter library."
+                )
+            adapter_constructor: UnitModelConstructor = AdapterLibrary[unit_model_type]
+            self.load_from_def(unit_model_def, adapter_constructor)
+
+    def load_from_def(
+        self, unit_model_def: UnitModelSchema, adapter_constructor: UnitModelConstructor
+    ) -> None:
+        """
+        Deserialise a unit model from a JSON object into a unit model adapter
+        """
+        # add the unit model to the flowsheet
+        unit_model =  add_unit_model_to_flowsheet(
+            unit_model_def, adapter_constructor, self.flowsheet_manager
+        )
+        
+        # store a reference to the adapter
+        self._unit_models[unit_model_def.id] = unit_model

ahuora_builder-0.1.0.dist-info/METADATA

@@ -0,0 +1,14 @@
+Metadata-Version: 2.4
+Name: ahuora-builder
+Version: 0.1.0
+Summary: Load a Ahuora .JSON file into a pyomo model.
+Requires-Python: >=3.14
+Requires-Dist: ahuora-builder-types
+Requires-Dist: ahuora-compounds
+Requires-Dist: common
+Requires-Dist: coverage==7.11.3
+Requires-Dist: idaes-pse==2.8.0
+Requires-Dist: pyomo==6.9.2
+Requires-Dist: scikit-learn==1.7.2
+Requires-Dist: scipy==1.16.3
+Requires-Dist: typing-validation==1.2.4

ahuora_builder-0.1.0.dist-info/RECORD

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