Re: [Rdkit-discuss] Method about calculating Pi electro negativity in rdkit

2018-11-12 Thread Greg Landrum
HI Xuan, This is not currently possible in the RDKit. -greg On Thu, Nov 8, 2018 at 8:35 PM Cao Xuan wrote: > Hi, > > Is there a method that can calculates the pi electronegativity of a given > atom in rdkit package? > > Thanks! > Xuan > > > > ___ >

[Rdkit-discuss] Method about calculating Pi electro negativity in rdkit

2018-11-08 Thread Cao Xuan
Hi, Is there a method that can calculates the pi electronegativity of a given atom in rdkit package? Thanks! Xuan ___ Rdkit-discuss mailing list Rdkit-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/rdkit-discuss