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webchem (version 0.0.3.1)
Chemical Information from the Web
Description
Chemical information from around the web. This package interacts with a suite of web APIs for chemical information.
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Install
install.packages('webchem')
Monthly Downloads
926
Version
0.0.3.1
License
MIT + file LICENSE
Issues
47
Pull Requests
6
Stars
156
Forks
40
Repository
https://github.com/ropensci/webchem
Maintainer
Eduard Szcs
Last Published
September 27th, 2015
Functions in webchem (0.0.3.1)
Search functions
cid_compinfo
Retrieve compound information from pubchem CID
csid_compinfo
Get record details (CSID, StdInChIKey, StdInChI, SMILES) by ChemSpider ID
cir_query
Query Chemical Identifier Resolver
csid_extcompinfo
Get extended record details by ChemSpider ID
get_csid
Retrieve ChemSpider ID
physprop
Query SRC PHYSPROP Database
etox_targets
Get Quality Targets from a ETOX ID
get_etoxid
Get ETOX ID
etox_tests
Get Tests from a ETOX ID
etox_basic
Get basic information from a ETOX ID
ppdb_query
Query the ppdb for information
pan
Query the PAN Pesticide database
webchem-deprecated
Deprecated function(s) in the webchem package
cts_compinfo
Get record details from Chemical Translation Service (CTS)
get_cid
Retrieve Pubchem Id (CID)
ppdb_buildidx
Query PPDB search index
ppdb_idx
PPDB search index
cts_convert
Convert Ids using Chemical Translation Service (CTS)
alanwood
Query http://www.alanwood.net/pesticides