obgrep used to guess the file type based on the extension but it does not seem
to work now.
Chris
On 8 Aug 2013, at 10:30, openbabel-discuss-requ...@lists.sourceforge.net wrote:
> Message: 2
> Date: Thu, 8 Aug 2013 09:59:54 +0200
> From: Pascal Muller
> Subject: Re: [Open Babel] Fwd: obgrep doe
On Tue, Jun 11, 2013 at 2:34 AM, Pascal Muller
wrote:
> Dear all,
>
> Usually, I use obgrep (Open Babel 2.3.2) with smiles files, but today I
> tried with an sdf - and it doesn't work. There is no match, and no error
> message (e.g.
> obgrep 'C' methane.sdf
> gives no output, as if there were no m
Dear all,
Usually, I use obgrep (Open Babel 2.3.2) with smiles files, but today I
tried with an sdf - and it doesn't work. There is no match, and no error
message (e.g.
obgrep 'C' methane.sdf
gives no output, as if there were no match. Tried with and without H in the
sdf).
With smiles format, obg
