Dear VOTCA users, I am trying to make modifications in my non-bonded potentials using iterative Boltzmann method. I wish to modify the non-bonded potentials between the head bead and the end bead of my coarse-grained molecule. I created an xml file according to my need but while running the csg_inverse command, I am getting an error as:
#
ERROR:
# critical: 'cp conf.gro
/home/iitj-ananya/Desktop/new-cg-a1/a1-traj-AA/replicate-along-z/nb-corrections/step_000'
failed #
Please tell me how to fix this error. I am attaching my .xml also, have a
look at it and let me know if it contains any mistake.
Thank You
ArS
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nb.xml
Description: XML document
