Guillaume,
I've been using this chapter from the Handbook of Chemoinformatics for the
3D descriptors:
http://michem.disat.unimib.it/chm/download/materiale/geometrical_descriptors.pdf
Section 2.6 has a discussion of the MoRSE descriptor, along with a
definition of the I values.
Is there sufficient info there for you?
-greg
On Fri, Oct 14, 2016 at 8:41 PM, Giuseppe Marco Randazzo <
gmranda...@gmail.com> wrote:
> This book >>> http://onlinelibrary.wiley.com/book/10.1002/9783527613106
> <<< that look like a bible.
>
> Best regards,
>
> GMR
>
>
>
>
>
> On 14 Oct 2016, at 19:28, Guillaume GODIN <guillaume.go...@firmenich.com>
> wrote:
>
> ​Dear All,
>
> I'm looking for the definition & values of the atomic "I-State" used in
> Dragon for RDF, MORSE descriptors.
>
> Do you have a source for those physical descriptors ?
>
> best regards,
>
> *Dr. Guillaume GODIN*
> Principal Scientist
> Chemoinformatic & Datamining
> Innovation
> CORPORATE R&D DIVISION
> DIRECT LINE +41 (0)22 780 3645
> MOBILE +41 (0)79 536 1039
> Firmenich SA
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