Hi Sharang (adding the list as I missed reply-all previously),
Glad to hear that RDKit does what it is supposed to.
I am unfortunately not familiar with how Datawarrior processes
molecules, so I don't know if it does its own layout. To remove RDKit
from the equation - if you can feed
Dear Quoc-Tuan,
I think I have come with a reasonably fast algorithm that seems to be
more robust:
https://gist.github.com/ptosco/dc4d27153e6e8e45aed654761e4d7409
Cheers,
p.
On 06/05/2020 09:11, Quoc-Tuan DO wrote:
Dear Paolo,
Thank you again for your code. Sorry for bothering you again.
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