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Helper functions for gismo export #439

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@markriegler markriegler commented Jun 17, 2024

Overview

I found the current implementation of exporting gismo-compatible xml-files regarding boundary conditions, custom functions and the assembly options too cumbersome and hard to read with all the nested curly brackets. Therefore, I added three new helper functions to gismo export: one for boundary conditions, one for a function block and one for the assembly options block. This should lead to clearer code.

New features

All related to gismo export.

  • Create boundary conditions block
  • Create function block
  • Create assembly options block
  • Add comment above one of these blocks

Showcase

New example examples/export_gismo.py recreates the xml-file for gismo's Poisson example.

Checklists

  • Documentations are up-to-date.
  • Added example(s)
  • Added test(s)

Summary by CodeRabbit

  • New Features

    • Introduced the ability to create and export multipatch geometry to a gismo-compatible XML file.
    • Added functionality to define boundary conditions, right-hand side functions, and manufactured solutions for geometry export.
    • New XML structure for multi-patch geometry, enhancing simulation capabilities.
  • Enhancements

    • Updated the gismo export module to include a new class for managing boundary conditions and assembly options.
    • Improved clarity of exported XML data with additional documentation parameters.
    • Enhanced usability with structured data blocks for easier representation of simulation parameters.
  • Testing

    • Added new test functions to validate the export of additional blocks and ensure comprehensive coverage of gismo export features.

@markriegler markriegler requested review from j042 and jzwar June 17, 2024 10:47
@j042
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j042 commented Jun 20, 2024

Are those all new features or can this replace any of the existing section?

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These are all new features.

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Walkthrough

The updates enhance the capability to create and export multipatch geometries in a gismo-compatible format, introducing a class for structured data management. Users can now easily define NURBS curves, set boundary conditions, and specify function blocks, streamlining the export process. The new features are thoroughly tested to ensure reliability, making the splinepy library more robust for computational simulations.

Changes

File Change Summary
examples/export_gismo.py Enhanced with functions to create multipatch geometries, define boundary conditions, and export XML for gismo compatibility.
splinepy/io/gismo.py Introduced the AdditionalBlocks class for managing structured data blocks, including methods for boundary conditions, function blocks, and assembly options, improving usability.
tests/io/test_gismo.py Added tests to validate the export of function blocks and additional XML blocks, ensuring data integrity and adherence to the defined XML structure.
tests/data/gismo_additional_blocks.xml New XML file defining a multi-patch geometry structure for simulations, including patches, boundaries, functions, and configuration options, ensuring detailed specification.

Sequence Diagram(s)

sequenceDiagram
    participant User
    participant export_gismo.py
    participant gismo
    participant gismo_io
    
    User->>export_gismo.py: Trigger export
    export_gismo.py->>gismo_io: Prepare geometries and boundaries
    gismo_io->>export_gismo.py: Return structured data
    export_gismo.py->>gismo: Call export with data
    gismo->>User: Exported XML File
Loading

Poem

In patches, our geometry thrives,
NURBS and boundaries come alive.
Functions bound, solutions clear,
Export to gismo, no fear.
With structured flow in files so neat,
Our code's journey is complete. 🎉


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Actionable comments posted: 0

Review details

Configuration used: CodeRabbit UI
Review profile: CHILL

Commits

Files that changed from the base of the PR and between 6d3e137 and 2bb9249.

Files selected for processing (2)
  • examples/export_gismo.py (1 hunks)
  • splinepy/io/gismo.py (2 hunks)
Additional comments not posted (8)
examples/export_gismo.py (4)

40-44: Approved: Function dirichlet_identifier correctly identifies Dirichlet boundaries.

The function uses a logical OR operation to determine if points meet the Dirichlet conditions, which is appropriate given the use of EPS to handle boundary precision.


51-64: Approved: Correct creation of function blocks for rhs and manufactured_solution.

The function blocks for right-hand side functions and manufactured solutions are created correctly using the new helper functions, with appropriate parameters for dimensions, function IDs, and descriptive comments.


67-84: Approved: Correct creation of boundary conditions and assembly options blocks.

The boundary conditions and assembly options blocks are correctly defined using the new helper functions, with all necessary parameters such as IDs, dimensions, and comments provided.


101-111: Approved: Correct modification of gismo.export() function call.

The function call to gismo.export() correctly includes the new function blocks and assembly options, ensuring that the XML file is generated with all necessary configurations.

splinepy/io/gismo.py (4)

709-801: Approved: Correct implementation of create_boundary_conditions_block function.

The function create_boundary_conditions_block correctly creates a structured Python dictionary for boundary conditions, which can be used effectively in the gismo export function. The parameters and dictionary structure are appropriately handled.


804-852: Approved: Correct implementation of create_function_block function.

The function create_function_block is well-implemented, supporting both scalar-valued and vector-valued functions. The dictionary structure and parameter handling are correct, facilitating its use in the gismo export function.


855-972: Approved: Correct implementation of create_assembly_options_block function.

The function create_assembly_options_block effectively creates a Python dictionary for g+smo assembly options. The handling of various parameters and the structure of the dictionary are appropriate for its intended use.


453-455: Approved: Correct update to _apply_options function to include comments.

The addition of the comment_text parameter in the _apply_options function allows for comments to be included in the XML output, which is a useful feature for clarity and documentation purposes.

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Actionable comments posted: 13

Review details

Configuration used: CodeRabbit UI
Review profile: ASSERTIVE

Commits

Files that changed from the base of the PR and between 2bb9249 and 10a19f0.

Files selected for processing (2)
  • examples/export_gismo.py (1 hunks)
  • splinepy/io/gismo.py (2 hunks)
Additional context used
Ruff
splinepy/io/gismo.py

766-766: Use is and is not for type comparisons, or isinstance() for isinstance checks

(E721)


833-833: Use is and is not for type comparisons, or isinstance() for isinstance checks

(E721)

Additional comments not posted (10)
examples/export_gismo.py (3)

6-7: Imports look good.

The import statements are appropriate for the functionality provided.


36-37: Ensure correct multipatch creation and interface determination.

The multipatch creation and interface determination look correct.


47-48: Ensure correct boundary setting.

The boundary setting looks correct.

splinepy/io/gismo.py (7)

709-717: Ensure correct function signature.

The function signature looks correct.


801-801: Ensure correct return statement.

The return statement looks correct.


804-817: Ensure correct function signature.

The function signature looks correct.


852-852: Ensure correct return statement.

The return statement looks correct.


855-867: Ensure correct function signature.

The function signature looks correct.


868-970: Ensure correct implementation of create_assembly_options_block.

The function implementation looks correct.


972-972: Ensure correct return statement.

The return statement looks correct.

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I think it's be easier to use this if you pack those helper functions in a class called CommentBlock. Can you think of anyway to test this?

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Actionable comments posted: 12

Review details

Configuration used: CodeRabbit UI
Review profile: ASSERTIVE

Commits

Files that changed from the base of the PR and between 10a19f0 and 913acdb.

Files selected for processing (4)
  • examples/export_gismo.py (1 hunks)
  • splinepy/io/gismo.py (2 hunks)
  • tests/data/gismo_additional_blocks.xml (1 hunks)
  • tests/io/test_gismo.py (2 hunks)
Additional comments not posted (7)
examples/export_gismo.py (1)

82-88: Ensure correct function block creation for manufactured solution.

The function block creation for the manufactured solution looks correct. Consider adding comments for better clarity.

    # Create function block for manufactured solution
+   # Exact solution for reference
    additional_blocks.add_function_block(
        dim=2,
        block_id=3,
        function_string="sin(pi*x) * sin(pi*y)",
        comment="The manufactured exact solution (for reference)",
    )

Likely invalid or redundant comment.

splinepy/io/gismo.py (6)

71-71: Use isinstance for type checking.

Use isinstance for type checks as suggested by static analysis tools.

- if not isinstance(func_text, tuple):
+ if not isinstance(func_text, tuple):

105-106: Ensure correct handling of comment text.

The handling of comment looks correct. Consider adding comments for better clarity.

+ # Append comment to XML if provided
  if comment is not None:
      bc_dict_for_xml["comment"] = comment

134-134: Use isinstance for type checking.

Use isinstance for type checks as suggested by static analysis tools.

- if not isinstance(function_string, tuple):
+ if not isinstance(function_string, tuple):

151-152: Ensure correct handling of comment text.

The handling of comment looks correct. Consider adding comments for better clarity.

+ # Append comment to XML if provided
  if comment is not None:
      function_dict["comment"] = comment

266-267: Ensure correct handling of comment text.

The handling of comment looks correct. Consider adding comments for better clarity.

+ # Append comment to XML if provided
  if comment is not None:
      assembly_dict["comment"] = comment

711-713: Ensure correct handling of comment text.

The handling of comment_text looks correct. Consider adding comments for better clarity.

comment_text = gismo_dictionary.get("comment", None)
+ # Append comment to XML if provided
if comment_text is not None:
    xml_data.append(_ET.Comment(comment_text))

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Actionable comments posted: 6

Review details

Configuration used: CodeRabbit UI
Review profile: ASSERTIVE

Commits

Files that changed from the base of the PR and between 913acdb and f64cc3b.

Files selected for processing (1)
  • tests/io/test_gismo.py (1 hunks)
Additional comments not posted (3)
tests/io/test_gismo.py (3)

307-307: Ensure temporary directory is properly cleaned up.

Using with statement ensures that the temporary directory is properly cleaned up.


279-285: Add comments for function blocks.

Adding comments will help understand the purpose of each block.

         # Function block for vector-valued variable
+        # Add a function block for a vector-valued function
         additional_blocks.add_function_block(
             dim=2,
             block_id=2,
             function_string=("x", "y"),
             comment="Vector-valued function",
         )

Likely invalid or redundant comment.


272-278: Add comments for function blocks.

Adding comments will help understand the purpose of each block.

         # Function block for scalar variable
+        # Add a function block for a scalar-valued function
         additional_blocks.add_function_block(
             dim=2,
             block_id=1,
             function_string="2*pi^2*sin(pi*x)*sin(pi*y)",
             comment="Scalar-valued function",
         )

Likely invalid or redundant comment.

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j042 commented Aug 16, 2024

Thanks for the update! Can you please go through the comments from the bot and mark them resolved afterwards? Feel free to leave a small comment if needed

@markriegler markriegler removed the request for review from jzwar August 19, 2024 07:32
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Actionable comments posted: 10

Review details

Configuration used: CodeRabbit UI
Review profile: ASSERTIVE

Commits

Files that changed from the base of the PR and between f64cc3b and 37ef6e2.

Files selected for processing (3)
  • examples/export_gismo.py (1 hunks)
  • splinepy/io/gismo.py (2 hunks)
  • tests/io/test_gismo.py (1 hunks)
Additional comments not posted (14)
examples/export_gismo.py (8)

85-91: Consider adding comments for function block creation.

The function block creation for the manufactured solution looks correct. Consider adding comments for better clarity.

    # Exact solution for reference

Likely invalid or redundant comment.


93-106: Consider adding comments for boundary conditions block creation.

The boundary conditions block creation looks correct. Consider adding comments for better clarity.

    # Define boundary conditions for the multipatch

Likely invalid or redundant comment.


14-21: Add a blank line after the docstring summary.

To follow PEP 257 conventions, add a blank line after the one-line summary in the docstring.

    """Recreate multipatch geometry from g+smo repository

    Returns

Likely invalid or redundant comment.


51-56: Ensure correct boundary identification logic.

The boundary identification function looks correct. Consider adding comments to explain the logic.

    # Points with y=0 or (x=0 and y=2) are identified as Dirichlet boundaries

Likely invalid or redundant comment.


64-73: Add a blank line after the docstring summary.

To follow PEP 257 conventions, add a blank line after the one-line summary in the docstring.

    """
    Create blocks for rhs, manufactured solution, boundary conditions and assembly
    options.

Likely invalid or redundant comment.


121-133: Consider adding comments for visualization of geometry and BCs.

The visualization code looks correct. Consider adding comments for better clarity.

    # Define boundary names for visualization

Likely invalid or redundant comment.


77-83: Consider adding comments for function block creation.

The function block creation for RHS looks correct. Consider adding comments for better clarity.

    # Right-hand side function for the Poisson equation

Likely invalid or redundant comment.


37-45: Consider adding comments to clarify the manipulation of control points.

Adding comments to explain the adjustment of control points for the outer arc can enhance clarity.

    # Adjust control points for the outer arc

Likely invalid or redundant comment.

tests/io/test_gismo.py (5)

274-274: Add a comment to explain the Python version check.

The condition checks if the Python version is greater than or equal to 3.9. Consider adding a comment to explain this check.

    # Check if Python version is 3.9 or higher

Likely invalid or redundant comment.


308-311: Add comments for assembly options block.

Adding comments will help understand the purpose of each block.

    # Add a block for assembly options

Likely invalid or redundant comment.


266-272: Add a docstring to describe the test.

Adding a docstring will help understand the purpose of the test.

    """
    Test the export of additional blocks, including scalar and vector function blocks,
    boundary conditions, and assembly options.
    """

Likely invalid or redundant comment.


293-306: Add comments for boundary conditions block.

Adding comments will help understand the purpose of each block.

    # Add a block for boundary conditions

Likely invalid or redundant comment.


276-276: Add a comment to explain the purpose of AdditionalBlocks.

Adding a comment will help understand the purpose of this class.

    # Initialize AdditionalBlocks to manage various blocks for export

Likely invalid or redundant comment.

splinepy/io/gismo.py (1)

711-714: Ensure correct handling of comment text.

The handling of comment_text looks correct. Consider adding comments for better clarity.

    # Append comment to XML if provided

Likely invalid or redundant comment.

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Actionable comments posted: 1

Review details

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Review profile: ASSERTIVE

Commits

Files that changed from the base of the PR and between 37ef6e2 and 982561d.

Files selected for processing (1)
  • splinepy/io/gismo.py (2 hunks)
Additional comments not posted (4)
splinepy/io/gismo.py (4)

23-113: Implementation of add_boundary_conditions_block is correct.

The method is well-structured and correctly uses isinstance for type checks. The changes are approved.


115-159: Implementation of add_function_block is correct.

The method is well-implemented, with appropriate handling of scalar and vector-valued functions. The changes are approved.


161-274: Implementation of add_assembly_options_block is correct.

The method is well-structured and efficiently manages parameters using lists. The changes are approved.


716-719: Implementation of _apply_options is correct.

The function correctly handles comment text and processes nested options. The changes are approved.

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Actionable comments posted: 1

Review details

Configuration used: CodeRabbit UI
Review profile: ASSERTIVE

Commits

Files that changed from the base of the PR and between 982561d and 184975f.

Files selected for processing (4)
  • examples/export_gismo.py (1 hunks)
  • splinepy/io/gismo.py (2 hunks)
  • tests/data/gismo_additional_blocks.xml (1 hunks)
  • tests/io/test_gismo.py (1 hunks)
Additional comments not posted (17)
examples/export_gismo.py (11)

64-73: Add a blank line after the docstring summary.

To follow PEP 257 conventions, add a blank line after the one-line summary in the docstring.

    """
    Create blocks for rhs, manufactured solution, boundary conditions and assembly
    options.
+
    Returns
    -----------
    additional_blocks: list<dict>
        List of dictionaries used for splinepy's gismo export function
    """

Likely invalid or redundant comment.


93-106: Ensure correct boundary conditions block creation.

The boundary conditions block creation looks correct. Consider adding comments for better clarity.

    # Define boundary conditions for the multipatch

Likely invalid or redundant comment.


85-91: Ensure correct function block creation for manufactured solution.

The function block creation for the manufactured solution looks correct. Consider adding comments for better clarity.

    # Exact solution for reference

Likely invalid or redundant comment.


51-56: Ensure correct boundary identification.

The boundary identification function looks correct. Consider adding comments to explain the logic.

    # Points with y < EPS or (x < EPS and y > 2 - EPS) are identified as Dirichlet boundaries

Likely invalid or redundant comment.


37-45: Ensure correct manipulation of control points.

The control points for arc_outer are correctly defined. Consider adding comments for better clarity.

    arc_outer = arc_inner.copy()
    # Adjust control points for the outer arc

Likely invalid or redundant comment.


135-141: Ensure correct export to XML file.

The export code looks correct. Consider adding comments for better clarity.

    # Export the multipatch geometry and options to an XML file

Likely invalid or redundant comment.


14-21: Add a blank line after the docstring summary.

To follow PEP 257 conventions, add a blank line after the one-line summary in the docstring.

    """Recreate multipatch geometry from g+smo repository
+
    Returns
    ---------
    multipatch: splinepy Multipatch
        Arc geometry consisting of two patches
    """

Likely invalid or redundant comment.


1-6: Ensure the docstring follows PEP 257 conventions.

The docstring should start with a one-line summary followed by a blank line and further description if needed.

"""
Export to g+smo-compatible xml-file.
+
Recreates poisson2d_bvp.xml from gismo repo
(see https://github.com/gismo/gismo/blob/stable/filedata/pde/poisson2d_bvp.xml)
"""

Likely invalid or redundant comment.


121-133: Ensure correct visualization of geometry and BCs.

The visualization code looks correct. Consider adding comments for better clarity.

    # Define boundary names for visualization

Likely invalid or redundant comment.


108-111: Ensure correct assembly options block creation.

The assembly options block creation looks correct. Consider adding comments for better clarity.

    # Define assembly options for the multipatch

Likely invalid or redundant comment.


77-83: Ensure correct function block creation for RHS.

The function block creation for RHS looks correct. Consider adding comments for better clarity.

    # Right-hand side function for the Poisson equation

Likely invalid or redundant comment.

tests/data/gismo_additional_blocks.xml (1)

2-2: Acknowledgment: Existing comment is sufficient.

The comment on the second line adequately indicates the purpose of the XML file.

tests/io/test_gismo.py (1)

266-329: LGTM! Ensure compatibility with other Python versions.

The test function test_gismo_export_additional_blocks is well-structured and comprehensive.

However, ensure that the test is compatible with other Python versions, especially if future changes are made to the codebase.

Run the following script to verify the test's compatibility with other Python versions:

Verification successful

Test Compatibility Confirmed for Python 3.9 and Above

The test function test_gismo_export_additional_blocks is designed to run only on Python versions 3.9 and above. It skips execution for versions below 3.8, ensuring compatibility with the intended Python versions.

  • Ensure that any future changes maintain this compatibility requirement.
Scripts executed

The following scripts were executed for the analysis:

Script:

#!/bin/bash
# Description: Verify compatibility of the test function with other Python versions.

# Test: Check for Python version compatibility. Expect: No issues with Python versions 3.9 and above.
grep -A 5 'def test_gismo_export_additional_blocks' tests/io/test_gismo.py

Length of output: 413


Script:

#!/bin/bash
# Description: Search for Python version-specific conditions or dependencies in the test file.

# Search for any Python version checks in the test file
rg 'python_version' tests/io/test_gismo.py -A 3

Length of output: 1100

splinepy/io/gismo.py (4)

14-18: LGTM! The class definition is well-structured.

The AdditionalBlocks class provides a centralized way to manage additional XML blocks for gismo export.


23-113: LGTM! The method implementation is correct.

The add_boundary_conditions_block method is well-structured and correctly implements the creation of boundary conditions blocks.


115-159: LGTM! The method implementation is correct.

The add_function_block method is well-structured and correctly implements the creation of function blocks.


161-274: LGTM! The method implementation is correct.

The add_assembly_options_block method is well-structured and correctly implements the creation of assembly options blocks.

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@j042 j042 changed the base branch from main to develop August 22, 2024 12:16
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Thanks! I only have some naming suggestions

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Can i merge this PR or do you do it?

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j042 commented Aug 26, 2024

I will

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