Thanks so much..its version 1.2.4..I hope it supports LAMMPS. I am now following the tutorials and the files need to be modified for LAMMPS i think.
On Monday, May 31, 2021 at 8:07:22 PM UTC+5:30 Christoph Junghans wrote: > On Mon, May 31, 2021 at 4:34 AM 'Tushita Rohilla' via votca > <[email protected]> wrote: > > > > Dear team, Hope you are doing great and are safe and healthy !!! > > > > I want to use VOTCA for running coarse-grained simulations of a polymer > and water system in LAMMPS. I have gone through the IBI and FM theory and > read papers. But I have not been able to figure our where to start. I have > only been able to install VOTCA through apt-get but dont know where it is > installed and how to use it. Along with this, I have only been able to > figure out through the files in the distribution that I shoud run an > all-atom simulation of atleast one polymer chain having sufficient number > of repeat units to capture forces in the dump file. That I find doable > still but then how to integrate it with VOTCA...please let me know..I will > be grateful...thanks.. > > First figure out what exact version you have installed, by running > csg_call --version or csg_stat --help. > > Then download the exact(!) same version of the tutorials from here: > https://github.com/votca/csg-tutorials/releases > > Once unpacked there is a guide/README you can follow. > > Christoph > > > > > > -Tushita > > > > -- > > Join us on Slack: https://join.slack.com/t/votca/signup > > --- > > 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 view this discussion on the web visit > https://groups.google.com/d/msgid/votca/8a6d9357-dad9-452b-a0be-7722c09f4b25n%40googlegroups.com > . > > > > -- > Christoph Junghans > Web: http://www.compphys.de > -- Join us on Slack: https://join.slack.com/t/votca/signup --- 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 view this discussion on the web visit https://groups.google.com/d/msgid/votca/477cd25a-5354-4943-b5da-676e58b49621n%40googlegroups.com.
