Am Donnerstag, 24. Mai 2018 19:27:06 UTC+2 schrieb Christoph Junghans: > > On Thu, May 24, 2018 at 11:24 AM, Marco Oestereich <[email protected] > <javascript:>> wrote: > > Hi there, > > > > is there a possibility to calculate the Thermodynamic Force in the > newest > > version? Until verion 1.3. it was possible but only with Gromacs. I > would > > like to calculate the force with espressopp. > Nope, I am sorry, we didn't had enough man power to support that feature. >
Ok, this is very unfortunate. Is there any possibility to download the tutorial files for the Thermodynamic Force. So I would try so install the old version of votca in a docker container with appropirate dependecies. So it would be nice if you could give me a hint, which versions of boost and fftw had been compatilbe for votca version 1.3.1 (and maybe the correct compiler). Best Marco > > Christoph > > > > Best regards > > Marco > > > > -- > > You received this message because you are subscribed to the Google > Groups > > "votca" group. > > To unsubscribe from this group and stop receiving emails from it, send > an > > email to [email protected] <javascript:>. > > To post to this group, send email to [email protected] > <javascript:>. > > Visit this group at https://groups.google.com/group/votca. > > For more options, visit https://groups.google.com/d/optout. > > > > -- > Christoph Junghans > Web: http://www.compphys.de > -- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To post to this group, send email to [email protected]. Visit this group at https://groups.google.com/group/votca. For more options, visit https://groups.google.com/d/optout.
