2016-08-31 8:35 GMT-06:00 ArS <[email protected]>: > Hi, > I included the configuration file to my working directory and to the xml > file as well, still the same error appears. Like Chandan said, something goes wrong when copying conf.gro, please refer to the more verbose error message at the end of inverse.log. There are two main errors, 1.) there is no "conf.gro" in the main directory, 2.) there is no space left on the drive.
Christoph > > > On Wednesday, August 31, 2016 at 7:27:35 PM UTC+5:30, Chandan Choudhury > wrote: >> >> The error indicates that conf.gro is missing. >> >> On Wed, Aug 31, 2016 at 7:21 AM, <[email protected]> wrote: >>> >>> Dear VOTCA users, >>> I am performing iterative Boltzmann method to modify non-bonded >>> interactions between a head bead and the end bead of my coarse-grained >>> molecule. I have prepared an .xml file according to the but while running >>> the csg_inverse command, I am getting the error note as: >>> >>> ERROR: >>> # critical: 'cp conf.gro >>> /home/iitj-ananya/Desktop/new-cg-a1/a1-traj-AA/replicate-along-z/nb-corrections/step_000' >>> failed >>> >>> Can you please tell me where I am making mistake. I am also attaching my >>> .xml file. Please have a look at it and let me know if it has any mistake. >>> >>> Thank You. >>> >>> -- >>> 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. >> >> >> >> >> -- >> >> Chandan Kumar Choudhury >> Post Doctoral Fellow >> Clemson University >> South Carolina >> USA >> >> "All work and no play makes Jack a dull boy...” > > -- > 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. -- 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.
