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OpenAPI Specification

openapi: 3.2.0
info:
  title: Chemaxon Molecule Cleaner API
  version: 26.1.3
  description: 'Operations tagged Molecule Cleaner across 2 of this provider''s published API definitions: chemaxon-structure-manipulation-openapi.json, chemaxon-structure-manipulation-openapi.yml. Each path carries the servers of the definition it was published in.'
servers:
- url: https://jchem-microservices.chemaxon.com/structure-manipulation
tags:
- name: Molecule Cleaner
paths:
  /rest-v1/structure/clean:
    post:
      operationId: cleanMolecule
      parameters:
      - in: query
        name: dim
        required: true
        schema:
          type: string
          description: which dimension should we clean into
          enum:
          - '0'
          - '2'
          - '3'
          example: 2
      - description: 'Clean options, described here: https://docs.chemaxon.com/display/docs/Cleaning+options'
        example: H
        in: query
        name: opts
        required: false
        schema:
          type: string
      - description: Indexes of fixed atoms (the coordinates of these atoms won't change).
        example:
        - 1
        in: query
        name: fixed
        required: false
        schema:
          type: array
          items:
            type: integer
            format: int32
      - description: the input format and options
        example: smiles
        in: query
        name: inputFormat
        required: false
        schema:
          type: string
      - in: query
        name: outputFormat
        required: false
        schema:
          type: string
          default: mrv
          description: the output format and/or options
      requestBody:
        content:
          text/plain:
            schema:
              type: string
              description: 'a plain text molecule. Example: c1ccccc1CC(N)C'
              example: c1ccccc1CC(N)C
        required: true
      responses:
        '200':
          content:
            text/plain:
              schema:
                type: string
          description: OK
        '400':
          content:
            text/plain:
              schema:
                type: string
          description: When not supported dimension is provided or molecule can not be parsed
        '500':
          content:
            text/plain:
              schema:
                type: string
          description: When clean can not be performed, or result can not be exported
      summary: Performs a clean operation on the given structure, and returns mrv
      tags:
      - Molecule Cleaner
    servers:
    - url: https://jchem-microservices.chemaxon.com/structure-manipulation
x-refined-from:
- chemaxon-structure-manipulation-openapi.json
- chemaxon-structure-manipulation-openapi.yml