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petosa / mongo_qcdb

MongoDB backend for storing quantum chemical databases
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Open dgasmith opened 7 years ago

dgasmith commented 7 years ago

We currently have:

{
  "molecule": "dbbacd78247e7b39ee5cb8e78d74423e98639203",
  "method": "A",
  "value_1": 123,
  "value_2": 234,
  "value_3": 345,
  "citation": "A. Smith and B. Jones",
  "link": "http://example.com"
}

Values should have the following names:

Citation and link should be replaced with a provenance field.

I think if you make the changes here and in databases we can probably generate some fake data to play with.

petosa commented 7 years ago

Citation and link should be replaced with a provenance field.

Should the provenance field have the same inner fields as the molecular provenance field?

dgasmith commented 7 years ago

Absolutely, lets keep it consistent.

Cheers, Daniel Smith

On Nov 30, 2016, at 11:41, Nick Petosa notifications@github.com wrote:

Citation and link should be replaced with a provenance field.

Should the provenance field have the same inner fields as the molecular provenance field?

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petosa commented 7 years ago

Added in 9c46631b36be2fe62bb8be75d763fc80de87a39b