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#1777 Some bonds don't display correctly in ChemDraw when opening a saved Ketcher CDX file. #1865

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Merged
merged 1 commit into from
Mar 22, 2024
Merged

#1777 Some bonds don't display correctly in ChemDraw when opening a saved Ketcher CDX file. #1865

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4 changes: 4 additions & 0 deletions api/tests/integration/ref/formats/cdx_export.py.out
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Original file line number Diff line number Diff line change
Expand Up @@ -8,6 +8,10 @@ two_bn:success
*** KET to CDX ***
issue_1774:success
issue_1775:success
molecule json loader: 'any' bonds are allowed only for queries
*** Try as Query ***
CDXML loader: Queries not supported
issue_1777:success
agents:success
*** CDXML to CDX ***
AlcoholOxidation_Rxn1:success
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16 changes: 8 additions & 8 deletions api/tests/integration/ref/formats/mol_to_cdxml.py.out
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Expand Up @@ -374,10 +374,10 @@ stereo_either-0020.mol
<b id="52" B="17" E="18"/>
<b id="53" B="17" E="19"/>
<b id="54" B="17" E="20"/>
<b id="55" B="16" E="21" Order="2"/>
<b id="56" B="21" E="22"/>
<b id="57" B="22" E="23" Order="2"/>
<b id="58" B="23" E="24"/>
<b id="55" B="16" E="21" Order="2" Display="Wavy"/>
<b id="56" B="21" E="22" Display="Wavy"/>
<b id="57" B="22" E="23" Order="2" Display="Wavy"/>
<b id="58" B="23" E="24" Display="Wavy"/>
<b id="59" B="24" E="25"/>
<b id="60" B="25" E="26"/>
<b id="61" B="25" E="27"/>
Expand All @@ -386,14 +386,14 @@ stereo_either-0020.mol
<b id="64" B="29" E="30"/>
<b id="65" B="29" E="31"/>
<b id="66" B="29" E="32"/>
<b id="67" B="33" E="23"/>
<b id="67" B="33" E="23" Display="Wavy"/>
<b id="68" B="33" E="34"/>
<b id="69" B="34" E="35"/>
<b id="70" B="34" E="36"/>
<b id="71" B="34" E="37"/>
<b id="72" B="33" E="38" Order="2"/>
<b id="73" B="39" E="38"/>
<b id="74" B="5" E="39" Order="2"/>
<b id="72" B="33" E="38" Order="2" Display="Wavy"/>
<b id="73" B="39" E="38" Display="Wavy"/>
<b id="74" B="5" E="39" Order="2" Display="Wavy"/>
</fragment>
</page>
</CDXML>
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1 change: 1 addition & 0 deletions api/tests/integration/tests/formats/cdx_export.py
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Expand Up @@ -72,6 +72,7 @@ def test_file(filename, suffix=".mol"):
print("*** KET to CDX ***")
test_file("issue_1774", ".ket")
test_file("issue_1775", ".ket")
test_file("issue_1777", ".ket")

root = joinPathPy("reactions/", __file__)
files = ["agents"]
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