Thanks for this answer, is there a reference for this Periodic Table File?
Best regards,
Colin Bournez
On Fri, Mar 10, 2017 at 7:17 PM, Guillaume GODIN <
guillaume.go...@firmenich.com> wrote:
> Dear Colin,
>
>
> Those values are not calculated, they come from a dictionary (the
> PeriodicalTable file).
>
>
> Best regards,
>
> *Dr. Guillaume GODIN*
> Principal Scientist
> Chemoinformatic & Datamining
> Innovation
> CORPORATE R&D DIVISION
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>
> ------------------------------
> *De :* Bournez Colin <bournez.co...@gmail.com>
> *Envoyé :* vendredi 10 mars 2017 16:51
> *À :* rdkit-discuss@lists.sourceforge.net
> *Objet :* [Rdkit-discuss] Van der Waals radius
>
> Dear all,
>
> Is it possible to know how the vdw radii are calculated with the
> function Chem.GetPeriodicTable().GetRvdw ?
>
> Colin Bournez
>
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