Re: [Open Babel] ​How to combine t​wo OB​Mol objects​ ​​in python?

2019-04-27 Thread Noel O'Boyle
Have you tried molA += molB? On Fri, 26 Apr 2019, 18:20 Lux QC, wrote: > Dear All, > > Greetings! > > What I want to do is to combine two molecules. > > I tried to combine two OBMol objects together, to obtain an OBMol object > which contains the coordinates of the two molecules. > > After

[Open Babel] Information on breaking API changes in forthcoming 3.0 release

2019-04-27 Thread Noel O'Boyle
Hi there, As we work towards the next release, Geoff has asked me to put together some documentation on the API changes introduced that might affect your code: https://open-babel.readthedocs.io/en/latest/UseTheLibrary/migration.html This not a "What's New?" - that will have to be done