Unfortunately not. That requires a technical solution.
There is actually some hope here though: SWIG 4.0 is capable of using
doxygen to generate javadoc:
http://www.swig.org/Doc4.0/SWIGDocumentation.html#Doxygen
That just requires someone with the time and motivation to try it out and
make
Hi there,
I'm trying to filter a compound list by PAINS filter.
With SMARTS query
'c1:c:c(:c:c:c:1-[#8]-[#6])-[#7;$([#7&!H0]-[#6]),$([#7](-[#6])-[#6])]'
KNIME can identify the following SMILES as a match
'N2C(C1(1)Cc3c2cc(c(c3)OC)OC)CC=C'
But I can't identify the same SMILES with RDkit
Would it be possible to add improving the docs for Java to the list?
e.g. https://sourceforge.net/p/rdkit/mailman/message/36929992/
Tim
On 23/04/2020 16:17, Scalfani, Vincent wrote:
Dear RDKit Community,
Greg and I are putting together an application for the Google Season
of the Docs
Dear RDKit Community,
Greg and I are putting together an application for the Google Season of the
Docs program:
https://developers.google.com/season-of-docs
The program connects open source organizations with technical writers. A
technical writer would work with several RDKit community
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