epam / epam/Indigo

Structures with query features cannot be dearomatized yet if input contains Not List atoms

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#726 0 comments 0 reactions 1 assignee Assigned to @even1024 View on GitHub
Dominant language
C++
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2d 11h
Merged PRs (30d)
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Description

**Steps to reproduce**
Call the v2/indigo/dearomatize

options: {
aromatize-skip-superatoms: true
gross-formula-add-isotopes: true
gross-formula-add-rsites: true
ignore-stereochemistry-errors: true
mass-skip-error-on-pseudoatoms: false
smart-layout: true
},
output_format: "chemical/x-indigo-ket"
struct:
[Structure with Not List atom.zip](https://github.com/epam/Indigo/files/8685452/Structure.with.Not.List.atom.zip)

Expected result
Structures with query features are Dearomatized
Respons HTTP 200 OK

Actual result
400 HTTP code is gotten with the following description:
{
"error": "'Structures with query features cannot be dearomatized yet"
}

Version 1.6.1.10-gd1a8a571b-x86_64-linux-gnu-10.2.1

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