So the example where you print the MW from SMILES worked just fine. As does
the following:
Dim OBConv As New OBConversion()
Dim Mol As New OBMol()
OBConv.SetInAndOutFormats("smi", "svg")
OBConv.ReadString(Mol, "CCC")
OBConv.WriteFile(Mol, "C:\output2.svg")
If, however, the output is a png, the file is generated, but it is not a
valid png file. If you change the extension to .txt and open it, it only
contains
" tEXtsmiles CCC ¿ ·X"
I've relentlessly googled it, and the only lead I have is that I might need
a cairo library? I'd really appreciate any help getting this to work, it's
integral to a project I'm working on. Thanks for your time.
On Wed, Jun 12, 2013 at 2:24 AM, Noel O'Boyle <[email protected]> wrote:
> So...what exactly did and didn't work? For example, can you read a
> SMILES string and print its molecular weight?
>
> - Noel
>
>
> On 11 June 2013 23:48, Matt Berlin <[email protected]> wrote:
> > Hello,
> > I've spent a fair amount of time today trying to figure out how to
> depict a
> > molecule as a .png using the .NET library. I'd like to be able to
> generate
> > pictures of all the molecules in an sd file using VB.net, and can't find
> any
> > easy way to go about this. Perhaps you can recommend something?
> >
> > --Matt
> >
> >
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