finalcif 176__tar.gz → 178__tar.gz

finalcif-178/LICENSE.md

@@ -0,0 +1,5 @@
+"THE BEER-WARE LICENSE" (Revision 42):
+Daniel Kratzert, dkratzert@gmx.de wrote this file.  As long as you retain
+this notice you can do whatever you want with this stuff. If we meet some day,
+and you think this stuff is worth it, you can buy me a beer in return.
+Dr. Daniel Kratzert

{finalcif-176 → finalcif-178}/PKG-INFO

@@ -1,13 +1,13 @@
 Metadata-Version: 2.5
 Name: finalcif
-Version: 176
+Version: 178
 Summary: CIF file editor
 Project-URL: Homepage, https://dkratzert.de/finalcif.html
 Project-URL: Bug Tracker, https://github.com/dkratzert/FinalCif/issues
 Author-email: Daniel Kratzert <dkratzert@gmx.de>
-License-File: LICENSE
+License-Expression: Beerware
+License-File: LICENSE.md
 Classifier: Development Status :: 5 - Production/Stable
-Classifier: License :: OSI Approved :: MIT License
 Classifier: Operating System :: OS Independent
 Classifier: Programming Language :: Python :: 3
 Classifier: Topic :: Scientific/Engineering :: Chemistry
@@ -33,16 +33,13 @@ Requires-Dist: qtpy
 Requires-Dist: requests
 Requires-Dist: shelxfile>=24
 Requires-Dist: urllib3==2.7.0
-Requires-Dist: wheel==0.47.0
 Description-Content-Type: text/markdown
 
 ![Latest Release](https://img.shields.io/github/v/tag/dkratzert/FinalCif?label=Release)
 [![Unit Tests](https://github.com/dkratzert/FinalCif/actions/workflows/python_tests.yml/badge.svg?branch=master)](https://github.com/dkratzert/FinalCif/actions/workflows/python_tests.yml)
 ![Contributions](https://img.shields.io/badge/contributions-welcome-blue)
-[![PyPI package](https://repology.org/badge/version-for-repo/pypi/python:finalcif.svg)](https://repology.org/project/python:finalcif/versions)
-<a href="https://repology.org/project/finalcif/versions">
-    <img src="https://repology.org/badge/vertical-allrepos/finalcif.svg" alt="Packaging status" align="right">
-</a>
+[![PyPI version](https://img.shields.io/pypi/v/finalcif.svg)](https://pypi.org/project/finalcif/)
+
 
 
 # FinalCif

{finalcif-176 → finalcif-178}/README.md

@@ -1,10 +1,8 @@
 ![Latest Release](https://img.shields.io/github/v/tag/dkratzert/FinalCif?label=Release)
 [![Unit Tests](https://github.com/dkratzert/FinalCif/actions/workflows/python_tests.yml/badge.svg?branch=master)](https://github.com/dkratzert/FinalCif/actions/workflows/python_tests.yml)
 ![Contributions](https://img.shields.io/badge/contributions-welcome-blue)
-[![PyPI package](https://repology.org/badge/version-for-repo/pypi/python:finalcif.svg)](https://repology.org/project/python:finalcif/versions)
-<a href="https://repology.org/project/finalcif/versions">
-    <img src="https://repology.org/badge/vertical-allrepos/finalcif.svg" alt="Packaging status" align="right">
-</a>
+[![PyPI version](https://img.shields.io/pypi/v/finalcif.svg)](https://pypi.org/project/finalcif/)
+
 
 
 # FinalCif

finalcif-178/finalcif/__init__.py

@@ -0,0 +1,3 @@
+
+VERSION = 178
+__version__ = VERSION

{finalcif-176 → finalcif-178}/finalcif/appwindow.py

@@ -21,7 +21,6 @@ from math import sin, radians
 from pathlib import Path, WindowsPath
 from typing import cast, TYPE_CHECKING
 
-
 if TYPE_CHECKING:
     from finalcif.cif.checkcif.checkcif import MyHTMLParser
 
@@ -1625,7 +1624,6 @@ class AppWindow(QMainWindow):
         """
         Generates a report document.
         """
-        from finalcif.report.tables import make_multi_tables
         from finalcif.report.templated_report import ReportFormat, TemplatedReport
         from docx.image.exceptions import UnrecognizedImageError
         current_block = self.ui.datanameComboBox.currentIndex()
@@ -1638,7 +1636,7 @@ class AppWindow(QMainWindow):
             return None
         self.load_cif_file(self.cif.finalcif_file, block=current_block, load_changes=False)
         report_filename = self.cif.finalcif_file_prefixed(prefix='report_', suffix='-finalcif.docx')
-        multi_table_document = self.cif.finalcif_file_prefixed(prefix='', suffix='-multitable.docx')
+        multi_table_document: Path | None = None
         self.cif.picometer = self.options.use_picometers
         # The picture after the header:
         if self.report_picture_path:
@@ -1652,9 +1650,12 @@ class AppWindow(QMainWindow):
             if template_path.suffix in ('.docx',):
                 t = TemplatedReport(format=ReportFormat.RICHTEXT, options=self.options, cif=self.cif)
                 ok = t.make_templated_docx_report(output_filename=str(report_filename),
-                                                  template_path=Path(self.get_checked_templates_list_text()))
-                if self.cif.is_multi_cif and self.cif.doc[0].name != 'global':
-                    make_multi_tables(cif=self.cif, output_filename=str(multi_table_document))
+                                                  template_path=template_path)
+                if (ok and self.cif.is_multi_cif and self.cif.doc[0].name != 'global'
+                        and not t.is_multi_cif_template):
+                    multi_table_document = self.cif.finalcif_file_prefixed(prefix='', suffix='-multitable.docx')
+                    ok = t.make_templated_docx_report(output_filename=str(multi_table_document),
+                                                      template_path=application_path / 'template' / 'template_for_multitable.docx')
             elif template_path.suffix in ('.html', '.tmpl'):
                 t = TemplatedReport(format=ReportFormat.HTML, options=self.options, cif=self.cif)
                 report_filename = report_filename.with_suffix('.html')
@@ -1687,16 +1688,16 @@ class AppWindow(QMainWindow):
             if DEBUG:
                 print('dbg> Unrecognized image error')
                 raise
-            show_general_warning(self,'The report contains an unrecognized image format.')
+            show_general_warning(self, 'The report contains an unrecognized image format.')
             return None
         if not self.running_inside_unit_test:
             self.open_report_document(report_filename, multi_table_document)
             # Save report and other files to a zip file:
-            self.zip_report(report_filename)
+            self.zip_report(report_filename, multi_table_document)
             return None
         return None
 
-    def zip_report(self, report_filename: Path) -> None:
+    def zip_report(self, report_filename: Path, multi_table_document: Path | None = None) -> None:
         from finalcif.report.archive_report import ArchiveReport
         zipfile = self.cif.finalcif_file.with_suffix('.zip')
         if zipfile.exists():
@@ -1711,16 +1712,16 @@ class AppWindow(QMainWindow):
         with suppress(Exception):
             pdfname = self.cif.finalcif_file_prefixed(prefix='checkcif-', suffix='-finalcif.pdf')
             arc.zip.write(filename=pdfname, arcname=pdfname.name)
-        with suppress(Exception):
-            multitable = self.cif.finalcif_file_prefixed(prefix='', suffix='-multitable.docx')
-            arc.zip.write(filename=multitable, arcname=multitable.name)
+        if multi_table_document is not None:
+            with suppress(Exception):
+                arc.zip.write(filename=multi_table_document, arcname=multi_table_document.name)
         with suppress(Exception):
             prp_list = self.cif.finalcif_file.parent.glob('*.prp')
             sorted_prp = sorted(prp_list, key=lambda x: x.stat().st_mtime)
             arc.zip.write(filename=sorted_prp[-1], arcname=sorted_prp[-1].name)
 
-    def open_report_document(self, report_filename: Path, multi_table_document: Path) -> None:
-        if self.cif.is_multi_cif:
+    def open_report_document(self, report_filename: Path, multi_table_document: Path | None = None) -> None:
+        if multi_table_document is not None:
             open_file(multi_table_document)
         open_file(report_filename)
 
@@ -2295,16 +2296,18 @@ class AppWindow(QMainWindow):
             d = 0.0
         self.ui.numRestraintsLineEdit.setText(self.cif['_refine_ls_number_restraints'])
         self.ui.thetaMaxLineEdit.setText(thetamax)
-        self.ui.thetaFullLineEdit.setText(self.cif['_diffrn_reflns_theta_full'])
+        theta_full = self.cif['_diffrn_reflns_theta_full']
+        self.ui.thetaFullLineEdit.setText(theta_full)
         self.ui.dLineEdit.setText(f"{d:5.3f}")
         try:
-            compl = float(self.cif['_diffrn_measured_fraction_theta_max']) * 100
+            fraction = self.cif['_diffrn_measured_fraction_theta_full']
+            compl = float(fraction) * 100
             if not compl:
                 compl = 0.0
         except (TypeError, ValueError):
             compl = 0.0
         try:
-            self.ui.completeLineEdit.setText(f"{compl:<5.1f}")
+            self.ui.completeLineEdit.setText(f"{compl:<5.1f} (at {theta_full}°)")
         except ValueError:
             pass
         self.ui.wavelengthLineEdit.setText(f"{wavelen}")

{finalcif-176 → finalcif-178}/finalcif/cif/hkl.py

@@ -34,10 +34,7 @@ class HKL:
 
     @property
     def hkl_as_cif(self) -> str:
-        if version.parse(gemmi.__version__) < version.parse('0.5.1'):
-            return self._doc.as_string(style=Style.Simple)
-        else:
-            return self._doc.as_string(options=gemmi.cif.WriteOptions(Style.Simple))
+        return self._doc.as_string(options=gemmi.cif.WriteOptions(Style.Simple))
 
     def _add_hkl_as_loop(self) -> None:
         """

{finalcif-176 → finalcif-178}/finalcif/gui/finalcif_gui_ui.py

@@ -2881,7 +2881,7 @@ class Ui_FinalCifWindow(object):
         self.CancelPropertiesButton.setText(QCoreApplication.translate("FinalCifWindow", u"Cancel", None))
         self.ExportPropertyButton.setText(QCoreApplication.translate("FinalCifWindow", u"Export", None))
         self.BackFromLoopsPushButton.setText(QCoreApplication.translate("FinalCifWindow", u"Back to CIF Table", None))
-        self.add_squeeze_pushButton.setText(QCoreApplication.translate("FinalCifWindow", u"Add Squeeze Info", None))
+        self.add_squeeze_pushButton.setText(QCoreApplication.translate("FinalCifWindow", u"Add/Edit Squeeze Info", None))
         self.deleteLoopButton.setText(QCoreApplication.translate("FinalCifWindow", u"Delete Loop", None))
         self.newLoopPushButton.setText(QCoreApplication.translate("FinalCifWindow", u"Add New Loop", None))
         self.revertLoopsPushButton.setText(QCoreApplication.translate("FinalCifWindow", u"Revert Changes", None))

{finalcif-176 → finalcif-178}/finalcif/gui/finalcif_gui_ui.ui

@@ -2861,7 +2861,7 @@ The data source will be ignored until next program restart.</string>
               <item row="0" column="2">
                <widget class="QPushButton" name="add_squeeze_pushButton">
                 <property name="text">
-                 <string>Add Squeeze Info</string>
+                 <string>Add/Edit Squeeze Info</string>
                 </property>
                </widget>
               </item>

{finalcif-176 → finalcif-178}/finalcif/gui/squeeze_dialog.py

@@ -18,14 +18,15 @@ from pathlib import Path
 from qtpy import QtCore, compat
 from qtpy.QtGui import QColor
 from qtpy.QtWidgets import (
-    QDialog, QDialogButtonBox, QHBoxLayout, QLabel, QMessageBox,
-    QPlainTextEdit, QPushButton, QSizePolicy, QTableWidget, QTableWidgetItem,
+    QAbstractItemView, QCompleter, QDialog, QDialogButtonBox, QHBoxLayout, QLabel, QLineEdit, QMessageBox,
+    QPlainTextEdit, QPushButton, QSizePolicy, QStyledItemDelegate, QTableWidget, QTableWidgetItem,
     QVBoxLayout, QWidget, QApplication
 )
 
 from finalcif.cif.cif_file_io import CifContainer
-from finalcif.cif.text import quote
-from finalcif.tools.squeeze import build_details_text, electrons_from_formula
+from finalcif.cif.text import quote, retranslate_delimiter
+from finalcif.tools.solvents import solvent_names
+from finalcif.tools.squeeze import build_details_text, electrons_from_formula, resolve_formula
 
 
 class SqueezeMode(Enum):
@@ -78,7 +79,9 @@ _MODE_CONFIG: dict[SqueezeMode, dict] = {
         'details_key'         : '_platon_squeeze_details',
         'title'               : 'PLATON SQUEEZE \u2013 Assign Solvent Content',
         'info'                : ('PLATON/SQUEEZE was used. '
-                                 'Assign the solvent formula per void <b>per unit cell</b>, e.g. <tt>2(H2O)</tt>.'),
+                                 'Assign the solvent formula per void <b>per unit cell</b>, e.g. <tt>2(H2O)</tt>.\n'
+                                 'Common solvent names like <tt>2 thf</tt> or <tt>toluene</tt> are '
+                                 'converted to their formula.'),
         'details_label'       : 'SQUEEZE details (<i>_platon_squeeze_details</i>):',
         'electrons_col_header': 'Electrons\n(PLATON)',
     },
@@ -91,7 +94,9 @@ _MODE_CONFIG: dict[SqueezeMode, dict] = {
         'details_key'         : '_smtbx_masks_special_details',
         'title'               : 'Olex2/SMTBX Masks \u2013 Assign Solvent Content',
         'info'                : ('Olex2/SMTBX solvent masks were used. '
-                                 'Assign the solvent formula per void <b>per unit cell</b>, e.g. <tt>2(H2O)</tt>.'),
+                                 'Assign the solvent formula per void <b>per unit cell</b>, e.g. <tt>2(H2O)</tt>.\n'
+                                 'Common solvent names like <tt>2 thf</tt> or <tt>toluene</tt> are '
+                                 'converted to their formula.'),
         'details_label'       : 'Masks details (<i>_smtbx_masks_special_details</i>):',
         'electrons_col_header': 'Electrons\n(Masks)',
     },
@@ -102,6 +107,19 @@ _COLOR_WARN = QColor(255, 200, 200)  # light red
 _COLOR_NEUTRAL = QColor(255, 255, 255)  # white
 
 
+class SolventNameDelegate(QStyledItemDelegate):
+    """Line edit delegate that autocompletes common solvent names."""
+
+    def createEditor(self, parent: QWidget, option, index) -> QWidget:
+        editor = QLineEdit(parent)
+        completer = QCompleter(solvent_names(), editor)
+        completer.setCaseSensitivity(QtCore.Qt.CaseSensitivity.CaseInsensitive)
+        completer.setFilterMode(QtCore.Qt.MatchFlag.MatchContains)
+        completer.setCompletionMode(QCompleter.CompletionMode.PopupCompletion)
+        editor.setCompleter(completer)
+        return editor
+
+
 class SqueezeSolventDialog(QDialog):
     """
     Modal dialog for entering PLATON SQUEEZE or Olex2/SMTBX solvent mask content.
@@ -212,6 +230,15 @@ class SqueezeSolventDialog(QDialog):
         self.table.setColumnWidth(_COL_FORMULA, 160)
         self.table.setColumnWidth(_COL_ELEC_CALC, 85)
         self.table.verticalHeader().setVisible(False)
+        self.table.setEditTriggers(
+            QAbstractItemView.EditTrigger.CurrentChanged
+            | QAbstractItemView.EditTrigger.SelectedClicked
+            | QAbstractItemView.EditTrigger.DoubleClicked
+            | QAbstractItemView.EditTrigger.AnyKeyPressed
+            | QAbstractItemView.EditTrigger.EditKeyPressed
+        )
+        self._solvent_delegate = SolventNameDelegate(self.table)
+        self.table.setItemDelegateForColumn(_COL_FORMULA, self._solvent_delegate)
         self.table.itemChanged.connect(self._on_formula_changed)
         layout.addWidget(self.table)
 
@@ -242,7 +269,7 @@ class SqueezeSolventDialog(QDialog):
         existing_details = self.cif[self._cfg['details_key']]
         if existing_details:
             self._details_user_modified = True
-            self.details_edit.setPlainText(existing_details)
+            self.details_edit.setPlainText(retranslate_delimiter(existing_details))
         self.details_edit.textChanged.connect(self._on_details_text_changed)
 
         # button box
@@ -408,9 +435,25 @@ class SqueezeSolventDialog(QDialog):
     def _on_formula_changed(self, item: QTableWidgetItem) -> None:
         if item.column() != _COL_FORMULA:
             return
+        self._resolve_item_formula(item)
         self._update_row_calculations(item.row())
         self._regenerate_details()
 
+    @staticmethod
+    def _resolve_item_formula(item: QTableWidgetItem) -> None:
+        """Replace a solvent name in *item* by its sum formula."""
+        text = item.text()
+        resolved = resolve_formula(text)
+        if resolved == text:
+            return
+        table = item.tableWidget()
+        blocked = table.signalsBlocked() if table else True
+        if table:
+            table.blockSignals(True)
+        item.setText(resolved)
+        if table:
+            table.blockSignals(blocked)
+
     def _update_row_calculations(self, row_idx: int) -> None:
         """Recalculate Electrons (calc.) and Δ for a given row."""
         formula_item = self.table.item(row_idx, _COL_FORMULA)
@@ -458,6 +501,7 @@ class SqueezeSolventDialog(QDialog):
             item = self.table.item(row_idx, _COL_FORMULA)
             if item:
                 item.setText(formula)
+                self._resolve_item_formula(item)
             self._update_row_calculations(row_idx)
         self.table.blockSignals(False)
         self._regenerate_details()
@@ -475,7 +519,7 @@ class SqueezeSolventDialog(QDialog):
                 'nr'              : row_idx + 1,
                 'volume'          : vol_item.text() if vol_item else '?',
                 'electrons_platon': elec_item.text() if elec_item else '?',
-                'formula'         : formula_item.text() if formula_item else '',
+                'formula'         : resolve_formula(formula_item.text()) if formula_item else '',
             })
         text = build_details_text(void_rows, method=self._loop_mode.value)
         # Block textChanged so our programmatic update doesn't set _details_user_modified
@@ -513,7 +557,7 @@ class SqueezeSolventDialog(QDialog):
         new_formulae: list[str] = []
         for row_idx in range(n_rows):
             item = self.table.item(row_idx, _COL_FORMULA)
-            formula = item.text().strip() if item else '?'
+            formula = resolve_formula(item.text()).strip() if item else '?'
             new_formulae.append(quote(formula) if formula else '?')
 
         # Reconstruct column data with the updated content column

{finalcif-176 → finalcif-178}/finalcif/report/references.py

@@ -5,10 +5,6 @@
 #  and you think this stuff is worth it, you can buy me a beer in return.
 #  Dr. Daniel Kratzert
 #  ----------------------------------------------------------------------------
-from contextlib import suppress
-from typing import Union
-
-from docx.text.paragraph import Paragraph
 from docxtpl import RichText
 
 from finalcif import VERSION
@@ -43,89 +39,6 @@ Missing: d*trek
 """
 
 
-class ReferenceList:
-    """
-    This reference list holds a list of all used references. During each self.append(Reference()), a new reference is
-    appended to the list. 
-    At the end of the document, a numbered list of references can be generated with self.make_make_literature_list().
-    """
-
-    def __init__(self, paragraph: Paragraph):
-        self.paragraph = paragraph
-        self._references = []
-
-    def append(self, ref: Union[list['Reference'], tuple['Reference'], 'Reference']) -> None:
-        """Adds a superscript list of reference numbers in brackets to the document."""
-        if isinstance(ref, list | tuple):
-            if not ref:
-                return None
-            self._append_list(ref)
-        else:
-            if ref not in self._references:
-                self._references.append(ref)
-            self.paragraph.add_run(f'[{self._references.index(ref) + 1}]').font.superscript = True
-        # better not here:
-        # self.paragraph.add_run(' ')
-
-    def _append_list(self, reflist: list) -> None:
-        reflst_long = []
-        self.paragraph.add_run('[').font.superscript = True
-        reflist = [x for x in reflist if x]
-        for n, ref in enumerate(reflist):
-            if ref not in self._references:
-                self._references.append(ref)
-            refnum = self._references.index(ref) + 1
-            reflst_long.append(refnum)
-        reftxt = self.get_sequence(reflst_long)
-        self.paragraph.add_run(reftxt).font.superscript = True
-        self.paragraph.add_run(']').font.superscript = True
-
-    @staticmethod
-    def get_sequence(stringlist: list[int]) -> str:
-        """
-        Converts a list of numbers into a string of numbers where recurring sequences
-        are described with a range.
-
-        >>> ReferenceList.get_sequence([1, 3, 4, 5, 6, 8, 11])
-        '1,3-6,8,11'
-        """
-        folg = []
-        start = 0
-        for n, val in enumerate(stringlist):
-            val = int(val)
-            nextval = 0
-            with suppress(IndexError):
-                nextval = int(stringlist[n + 1])
-            nextnext = 0
-            with suppress(IndexError):
-                nextnext = int(stringlist[n + 2])
-            # a sequence starts:
-            if nextnext == val + 2 and not start:
-                start = val
-            # in a sequence and next value is not +1 -> squence ends with val:
-            if start and nextval != val + 1:
-                folg.append(f'{start}-{val}')
-                start = 0
-                continue
-            # everything outside a sequence:
-            if not start:
-                folg.append(val)
-        return ','.join([str(x) for x in folg])
-
-    def make_literature_list(self, document):
-        if len(self._references) < 10:
-            template = 'references_ni'
-        else:
-            template = 'references'
-        for num, ref in enumerate(self._references, 1):
-            paragraph_reflist = document.add_paragraph('', template)
-            paragraph_reflist.add_run(f'[{num!s}] \t')
-            ref.add_reference(paragraph_reflist)
-
-    def __repr__(self):
-        return '\n'.join([f'[{num}] {x}' for num, x in enumerate(self._references)])
-
-
 class Reference:
     def __init__(self):
         self.authors = ''
@@ -137,31 +50,6 @@ class Reference:
         self.program = ''
         self.count = 0
 
-    def add_reference(self, p: Paragraph) -> None:
-        if self.authors:
-            p.add_run(self.authors)
-            p.add_run(', ')
-        if self.journal:
-            p.add_run(self.journal).italic = True
-            if not self.journal.endswith('.'):
-                p.add_run(', ')
-            else:
-                p.add_run(' ')
-        if self.year:
-            p.add_run(self.year).bold = True
-            p.add_run(', ')
-        if self.volume:
-            p.add_run(self.volume).italic = True
-            p.add_run(', ')
-        if self.pages:
-            p.add_run(self.pages)
-            if self.doi:
-                p.add_run(', ')
-        if self.doi:
-            p.add_run(self.doi)
-        if any([self.journal, self.pages, self.year, self.volume, self.doi]):
-            p.add_run('.')
-
     @property
     def richtext(self) -> RichText:
         r = RichText('')
@@ -589,8 +477,3 @@ class CrysalisProReference(Reference):
         self.journal = version
         self.year = year
         self.pages = pages
-
-
-if __name__ == '__main__':
-    r = ReferenceList.get_sequence([1, 2, 3, 6])
-    print(r)

{finalcif-176 → finalcif-178}/finalcif/report/report_text.py

@@ -1,18 +1,14 @@
 import os
 
 import gemmi
-from docx import Document
 from docx.oxml.xmlchemy import BaseOxmlElement
-from docx.text.paragraph import Paragraph
-from docx.text.run import Run
 from lxml import etree
 from lxml.etree import XSLTAccessControl
 
 from finalcif.app_path import application_path
 from finalcif.cif.cif_file_io import CifContainer
 from finalcif.cif.text import retranslate_delimiter, string_to_utf8
-from finalcif.report import references
-from finalcif.tools.misc import (protected_space, angstrom, remove_line_endings)
+from finalcif.tools.misc import angstrom, remove_line_endings
 
 
 def math_to_word(eq: str) -> BaseOxmlElement:
@@ -57,41 +53,6 @@ def _get_cooling_device(cif: CifContainer) -> str:
         return ''
 
 
-class FormatMixin:
-
-    def bold(self, run: Run):
-        r = run.bold = True
-        return r
-
-
-class SpaceChar:
-    def __init__(self, paragraph: Paragraph):
-        self.p = paragraph
-
-    def regular(self) -> None:
-        self.p.add_run(' ')
-
-    def protected(self):
-        self.p.add_run(protected_space)
-
-
-class RefinementDetails:
-    def __init__(self, cif: CifContainer, document: Document):
-        ph = document.add_paragraph(style='Heading 2')
-        ph.add_run(text=fr"Refinement details for {cif.block.name}")
-        p = document.add_paragraph()
-        try:
-            p.style = document.styles['fliesstext']
-        except KeyError:
-            print('DBG> Text style not found')
-        text = ' '.join(cif['_refine_special_details'].splitlines(keepends=False))
-        if cif['_olex2_refine_details']:
-            text += ' '.join(cif['_olex2_refine_details'].splitlines(keepends=False))
-        # Replacing semicolon, because it can damage the CIF:
-        text = text.replace(';', '.')
-        p.add_run(string_to_utf8(text).strip())
-
-
 def get_inf_article(next_word: str) -> str:
     if not next_word:
         return 'a'
@@ -133,13 +94,3 @@ def format_radiation(radiation_type: str) -> list:
         return radtype
     else:
         return radtype
-
-
-def make_report_text(cif, document: Document) -> references.ReferenceList:
-    paragr = document.add_paragraph()
-    try:
-        paragr.style = document.styles['fliesstext']
-    except KeyError:
-        print('DBG> Text style not found')
-    ref = references.ReferenceList(paragr)
-    return ref