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swh:1:snp:f2a036221b848b423bd011c9c4439510d269a331
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    • a373a81
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    • FAIRmat-NFDI-pynxtools-xps-53ea2fd
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    • generate_ref_comments_jsons.py
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    swh:1:rel:d34c837423b05e387c5491b712d5b4141e9dc772

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    Generate software citation in BibTex format (requires biblatex-software package)
    Generating citation ...
    Generate software citation in BibTex format (requires biblatex-software package)
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    Generate software citation in BibTex format (requires biblatex-software package)
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    Generate software citation in BibTex format (requires biblatex-software package)
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    generate_ref_comments_jsons.py
    # Copyright The NOMAD Authors.
    #
    # This file is part of NOMAD. See https://nomad-lab.eu for further info.
    #
    # Licensed under the Apache License, Version 2.0 (the "License");
    # you may not use this file except in compliance with the License.
    # You may obtain a copy of the License at
    #
    #     http://www.apache.org/licenses/LICENSE-2.0
    #
    # Unless required by applicable law or agreed to in writing, software
    # distributed under the License is distributed on an "AS IS" BASIS,
    # WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
    # See the License for the specific language governing permissions and
    # limitations under the License.
    #
    
    """
    Regenerate reference JSON files for testing the VAMAS comment extraction.
    """
    
    import os
    import json
    import numpy as np
    from pynxtools_xps.vms.vamas_comment_handler import handle_comments
    
    
    def read_comment_file(filepath: str):
        """Read comments from one vms comment test file."""
    
        no_of_comments = 0
        comment_lines = []
    
        with open(filepath, "rb") as vms_file:
            for i, line in enumerate(vms_file):
                if i == 0:
                    no_of_comments = int(line)
                else:
                    comment_lines += [line.decode("utf-8", errors="ignore").strip()]
    
        return no_of_comments, comment_lines
    
    
    def generate_ref_comment_jsons():
        """This generates reference json files for the vms comment handler."""
        files = [
            ("kratos.vms", "block"),
            ("phi.vms", "block"),
            ("casa_header.vms", "header"),
            ("casa_process.vms", "block"),
            ("specs_header.vms", "header"),
            ("specs_block.vms", "block"),
        ]
    
        for file, comment_type in files:
            filepath = os.path.join(
                os.path.dirname(__file__), "..", "tests", "data", "vms_comments", file
            )
            ref_json_filepath = filepath.replace(".vms", "_ref.json")
    
            _, comment_lines = read_comment_file(filepath)
    
            comments = handle_comments(comment_lines, comment_type=comment_type)
    
            if file == "casa_process.vms":
                casa_process = comments["casa"]
                comments = casa_process.flatten_metadata()
    
            for key, val in comments.items():
                if isinstance(val, np.ndarray):
                    comments[key] = val.tolist()
    
            with open(ref_json_filepath, "w") as json_file:
                json.dump(comments, json_file, indent=4)
    
    
    if __name__ == "__main__":
        generate_ref_comment_jsons()
    

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