Maybe include the molecular dynamics algorithm in Avogadro2

It is on the roadmap. :slight_smile:

I believe Geoff’s primary goal/condition for 2.0 is that it should essentially have feature parity with 1.2, so if you take a look at the roadmap and find that something key to your usage of 1.2 is not there (and is not implemented already), I would recommend bringing it up!