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When adding a new compound to the compounds table there is a drop down box for selecting the Chemical Class. Sometimes more than one chemical class needs to be selected.
The select multiple input …
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It looks like this brick is a tox21 brick? In any case comptox.epa.gov has a lot of data that isn't present in this brick. For example, this table associated compounds with hazards is available on the…
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Hi,
I'm using xml2json to parse publications and have the following problem:
If the text in the abstract node contains XML-tags, the text following these seub-nodes is just ignored in the JSON o…
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https://arxiv.org/abs/1610.02415v1
Directly related to #52 and #53. Somewhat related to #45, #55, and #56. This preprint examines an autoencoder-based method for representing molecules with continuou…
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Here is the [discussion issue template](https://github.com/Zainab-ik/Creating-issue-templates/blob/main/.github/ISSUE_TEMPLATE/discussion.yml).
Below is a sample specific to _**eos80ch**_
- **Bi…
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Given two identified nodes, return any subgraph path which connects them (by diverse, user set criteria of “similarity”?). Infer what kind of similarity metric is needed (by category types).
Connecte…
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Regarding the UseCase of ChemicalSubstance, I would like to use it as a property of a hypothetical Crystallization Experiment BioSchema. Thus, I believe that by adding few properties (see below) to Ch…
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Hi @OpenSourceMycetoma/corecontrib
Rohan has gotten back to us Re: potential compounds for screening
A few points:
1. Can we work with sdf's for chemical structure analysis, or do we want Chem…
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I would like to add a module for m/z calibration of peak lists based on compounds with known chemical formulas.
Something like this:
![screen shot 2016-02-16 at 13 54 03](https://cloud.githubusercon…