webchem
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Chemical Information from the Web
The webchem package could use a logo. The natural choice is, of course, a benzene ring, but it would be great if it indicated a little more about what webchem...
--- ## Add function to query SMARTS viewer API Generate a visualization of a SMARTS string using the SMARTSvierwer API provided by ZBH-Center for Bioinformatics at Universitat Hamburg. (https://smartsview.zbh.uni-hamburg.de/rest). For...
I imagine in addition to citing webchem, people using this package may also want to (or be technically required to) cite the databases that webchem accesses. It might be a...
ACToR
"EPA’s Aggregated Computational Toxicology Online Resource (ACToR) aggregates data from thousands of public sources on over 500,000 chemicals. It is searchable by chemical name and other identifiers. ACToR is also...
Eg. solubility should have the same name and unit through the results returned.
https://apps.ideaconsult.net/data/help http://ideaconsult.github.io/examples-ambit/apidocs/ BCF database: http://ambit.sourceforge.net/euras/
Checkout EPA chemistry dashboard. https://comptox.epa.gov/dashboard/dsstoxdb/results?search=1071-83-6