Try the "Structure Validator" tool, What do you think about it?

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Structure Validator is a web-based service that confirm chemical identity and provide real-time feedback on the machine-readability of chemical data and metadata representation. ( For demonstration only)

https://pubchem.ncbi.nlm.nih.gov/resolver/resolver.cgi?action=input_form

We want you to test it before the official launch and let us know what went well and went bad.

Thank you for participating in this effort.

WorldFAIR “Global cooperation on FAIR data policy and practice” is funded by the EC HORIZON-WIDERA-2021-ERA-01-41 Coordination and Support Action under Grant Agreement No. 101058393.

When looking up chemicals by chemical structure, what options are most important for you and your use cases? (choose all that apply)

Exact structure

Same Stereo (isotopes can vary)

Same Isotopes (stereo can vary)

Same connectivity (isotopes and stereo can vary)

Same charge state

Same tautomer/resonance form

Same molecular formula

Other:

Required

When checking a chemical structure for validity, what options are most important for you and your use cases? (choose all that apply)

Check that all elements are correct

Allow variable atoms (‘*’ atoms)

Allow unspecified stereo centers (not all stereo centers indicated)

Allow variable attachment points (e.g., unspecified xylene)

Allow unspecified oxidation state (e.g., uncharged metal atoms)

Recognize inorganic stereo centers

Recognize non-covalent bonds (e.g., banana bonds, zero-order bonds)

Other:

Required

What are your needs for a common web-based programmatic interface, where there is one standard way to communicate chemical information across websites?

Beyond checking a chemical structure for validity and looking up a chemical structure, what other functions would you like to see “normalized” across chemistry websites?

How important are bulk (multi-structure) operations for your use case(s)? (pick one)

Not important

Somewhat important

Very important

Other (enter in text box)

How would a single chemistry interface (across all chemistry websites) revolutionize your work?

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