Re: [Open Babel] is there a seed in obabel?

2020-12-02 Thread Pedro Lacerda
I face the same issue. Em qua, 2 de dez de 2020 08:18, Antonio Jesús Banegas Luna < ajbane...@ucam.edu> escreveu: > Hello, > > I'm using obabel for converting smiles to 3d mol2 with --gen3D. However, > when I run the command on another machine I get a different set of > coordinates that make the

[Open Babel] is there a seed in obabel?

2020-12-02 Thread Antonio Jesús Banegas Luna
Hello, I'm using obabel for converting smiles to 3d mol2 with --gen3D. However, when I run the command on another machine I get a different set of coordinates that make the rest of my script fail. I'd like to obtain always the same coordinates and I was wondering if obabel accepts a seed or