Re: [Rdkit-discuss] RDKit and organometallics

2018-11-13 Thread Henrique Castro
From: Michal Krompiec Sent: Tuesday, November 13, 2018 11:16 To: malgorzata.wer...@molecularhealth.com Cc: henrique...@outlook.com; RDKit Discuss Subject: Re: [Rdkit-discuss] RDKit and organometallics Isn't this patch already incorporated in the master branch? On Tue

Re: [Rdkit-discuss] RDKit and organometallics

2018-11-13 Thread Michal Krompiec
ng.dk/useful-information/how-to-solve-problems-with-coordinate-bonds-in-rdkit/ > > > > Best, > > Malgorzata > > -- > *From:* Henrique Castro > *Sent:* 13 November 2018 11:57:34 > *To:* rdkit-discuss@lists.sourceforge.net > *Subject:* [

Re: [Rdkit-discuss] RDKit and organometallics

2018-11-13 Thread Malgorzata Werner
To: rdkit-discuss@lists.sourceforge.net Subject: [Rdkit-discuss] RDKit and organometallics Dear colleagues, I know that this is probably a dumb question, but since my searches showed no clarifying results I'm asking here anyway. I'm planning to use RDKit on my Ph.D. thesis, but my field of research

[Rdkit-discuss] RDKit and organometallics

2018-11-13 Thread Henrique Castro
Dear colleagues, I know that this is probably a dumb question, but since my searches showed no clarifying results I'm asking here anyway. I'm planning to use RDKit on my Ph.D. thesis, but my field of research is inorganic chemistry and molecular magnetism. That means that I'm dealing with