#2412 - User can't correctly save (or make a layout) to RDF/RXN reaction several products or with separate positioned molecules #5202
GitHub Actions / ubuntu-latest-x86_64-python_test_report
failed
Jan 17, 2025 in 0s
285 tests run, 284 passed, 0 skipped, 1 failed.
Annotations
Check failure on line 1 in api/c/tests/unit/tests/formats.cpp
github-actions / ubuntu-latest-x86_64-python_test_report
formats.ket_cdxml
[FAILED]
Raw output
Diff:
- multi_overlap.cdxml:SUCCEED
+ multi_overlap.cdxml:FAILED
- multi_overlap.ket:SUCCEED
+ ---
+ +++
+ @@ -30,13 +30,13 @@
+ <s font="3" size="10" face="32">2</s>
+ </t>
+ </n>
+ - <b id="48" B="7" E="5" Order="2"/>
+ - <b id="49" B="8" E="6" Order="2"/>
+ - <b id="50" B="5" E="9"/>
+ - <b id="51" B="6" E="7"/>
+ - <b id="52" B="9" E="10" Order="2"/>
+ - <b id="53" B="10" E="8"/>
+ - <b id="54" B="6" E="11"/>
+ + <b id="46" B="7" E="5" Order="2"/>
+ + <b id="47" B="8" E="6" Order="2"/>
+ + <b id="48" B="5" E="9"/>
+ + <b id="49" B="6" E="7"/>
+ + <b id="50" B="9" E="10" Order="2"/>
+ + <b id="51" B="10" E="8"/>
+ + <b id="52" B="6" E="11"/>
+ </fragment>
+ <fragment id="12">
+ <n id="13" p="289.138000 246.374496"/>
+ @@ -50,56 +50,49 @@
+ <s font="3" size="10" face="96">O</s>
+ </t>
+ </n>
+ - <b id="55" B="13" E="18"/>
+ - <b id="56" B="13" E="14"/>
+ - <b id="57" B="14" E="15"/>
+ - <b id="58" B="15" E="16"/>
+ - <b id="59" B="16" E="17"/>
+ - <b id="60" B="17" E="18"/>
+ - <b id="61" B="18" E="19" Order="2"/>
+ + <b id="53" B="13" E="18"/>
+ + <b id="54" B="13" E="14"/>
+ + <b id="55" B="14" E="15"/>
+ + <b id="56" B="15" E="16"/>
+ + <b id="57" B="16" E="17"/>
+ + <b id="58" B="17" E="18"/>
+ + <b id="59" B="18" E="19" Order="2"/>
+ </fragment>
+ <fragment id="20">
+ - <n id="21" Element="17" NumHydrogens="1" p="419.962280 239.779602">
+ - <t p="419.962280 239.779602" LabelJustification="Left">
+ - <s font="3" size="10" face="96">ClH</s>
+ - </t>
+ - </n>
+ + <n id="21" p="541.702454 270.462097"/>
+ + <n id="22" p="541.591370 240.603302"/>
+ + <n id="23" p="511.339081 270.074677"/>
+ + <n id="24" p="511.264008 240.603302"/>
+ + <b id="60" B="21" E="22"/>
+ + <b id="61" B="21" E="23"/>
+ + <b id="62" B="22" E="24"/>
+ + <b id="63" B="23" E="24"/>
+ </fragment>
+ - <fragment id="22">
+ - <n id="23" p="541.702454 270.462097"/>
+ - <n id="24" p="541.591370 240.603302"/>
+ - <n id="25" p="511.339081 270.074677"/>
+ - <n id="26" p="511.264008 240.603302"/>
+ - <b id="62" B="23" E="24"/>
+ - <b id="63" B="23" E="25"/>
+ - <b id="64" B="24" E="26"/>
+ - <b id="65" B="25" E="26"/>
+ + <fragment id="25">
+ + <n id="26" p="586.042419 267.974121"/>
+ + <n id="27" p="616.079956 267.974121"/>
+ + <n id="28" p="601.062683 242.025894"/>
+ + <b id="64" B="26" E="27"/>
+ + <b id="65" B="26" E="28"/>
+ + <b id="66" B="27" E="28"/>
+ </fragment>
+ - <fragment id="27">
+ - <n id="28" p="586.042419 267.974121"/>
+ - <n id="29" p="616.079956 267.974121"/>
+ - <n id="30" p="601.062683 242.025894"/>
+ - <b id="66" B="28" E="29"/>
+ - <b id="67" B="28" E="30"/>
+ - <b id="68" B="29" E="30"/>
+ + <fragment id="29">
+ + <n id="30" p="781.716187 266.926453"/>
+ + <n id="31" p="781.605164 237.073532"/>
+ + <n id="32" p="751.358887 266.539093"/>
+ + <n id="33" p="751.283813 237.073532"/>
+ + <b id="67" B="30" E="31"/>
+ + <b id="68" B="30" E="32"/>
+ + <b id="69" B="31" E="33"/>
+ + <b id="70" B="32" E="33"/>
+ </fragment>
+ - <fragment id="31">
+ - <n id="32" p="781.716187 266.926453"/>
+ - <n id="33" p="781.605164 237.073532"/>
+ - <n id="34" p="751.358887 266.539093"/>
+ - <n id="35" p="751.283813 237.073532"/>
+ - <b id="69" B="32" E="33"/>
+ - <b id="70" B="32" E="34"/>
+ - <b id="71" B="33" E="35"/>
+ - <b id="72" B="34" E="35"/>
+ - </fragment>
+ - <arrow id="36" BoundingBox="483.724365 258.533142 370.452087 260.783630" FillType="None" ArrowheadType="Solid" HeadSize="2250" ArrowheadWidth="563" ArrowheadHead="Full" ArrowheadCenterSize="25" Head3D="483.724365 258.533142 0.000000" Tail3D="370.452087 260.783630 0.000000"/>
+ - <arrow id="39" BoundingBox="725.250000 255.000000 640.500000 256.500000" FillType="None" ArrowheadType="Solid" HeadSize="2250" ArrowheadWidth="563" ArrowheadHead="Full" ArrowheadCenterSize="25" Head3D="725.250000 255.000000 0.000000" Tail3D="640.500000 256.500000 0.000000"/>
+ - <graphic id="42" BoundingBox="257.992737 266.998779 257.992737 259.498779" GraphicType="Symbol" SymbolType="Plus"/>
+ - <graphic id="45" BoundingBox="562.811218 257.250000 562.811218 249.750000" GraphicType="Symbol" SymbolType="Plus"/>
+ + <arrow id="34" BoundingBox="483.724365 258.533142 370.452087 260.783630" FillType="None" ArrowheadType="Solid" HeadSize="2250" ArrowheadWidth="563" ArrowheadHead="Full" ArrowheadCenterSize="25" Head3D="483.724365 258.533142 0.000000" Tail3D="370.452087 260.783630 0.000000"/>
+ + <arrow id="37" BoundingBox="725.250000 255.000000 640.500000 256.500000" FillType="None" ArrowheadType="Solid" HeadSize="2250" ArrowheadWidth="563" ArrowheadHead="Full" ArrowheadCenterSize="25" Head3D="725.250000 255.000000 0.000000" Tail3D="640.500000 256.500000 0.000000"/>
+ + <graphic id="40" BoundingBox="257.992737 266.998779 257.992737 259.498779" GraphicType="Symbol" SymbolType="Plus"/>
+ + <graphic id="43" BoundingBox="562.811218 257.250000 562.811218 249.750000" GraphicType="Symbol" SymbolType="Plus"/>
+ <scheme>
+ - <step ReactionStepReactants="4 12" ReactionStepProducts="22 27" ReactionStepArrows="36"/>
+ - <step ReactionStepReactants="22 27" ReactionStepProducts="31" ReactionStepArrows="39"/>
+ + <step ReactionStepReactants="4 12" ReactionStepProducts="20 25" ReactionStepArrows="34"/>
+ + <step ReactionStepReactants="20 25" ReactionStepProducts="29" ReactionStepArrows="37"/>
+ </scheme>
+ </page>
+ </CDXML>
+ multi_overlap.ket:FAILED
+ ---
+ +++
+ @@ -15,9 +15,6 @@
+ },
+ {
+ "$ref": "mol4"
+ - },
+ - {
+ - "$ref": "mol5"
+ },
+ {
+ "type": "arrow",
+ @@ -482,19 +479,5 @@
+ ]
+ }
+ ]
+ - },
+ - "mol5": {
+ - "type": "molecule",
+ - "atoms": [
+ - {
+ - "label": "Cl",
+ - "location": [
+ - 13.998743057250977,
+ - -7.9926533699035648,
+ - 0.0
+ - ]
+ - }
+ - ],
+ - "bonds": []
+ }
+ }
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