Dear Votca users, I am just starting to use votca with lammps. I tried
running the example 'csg-tutorials/spce/ibi_lammps'. I didn't change
anything in the given script (except for the lammps command). I get the
following error and I don't seem to understand why. Please help. Thanks in
advance.
*Running critical command 'csg_stat --nt 64 --options
/home/va83ruvu/votca/src/csg-tutorials/spce/ibi_lammps/settings.xml --top
topol.xml --trj traj.dump --begin 0 --first-frame 0'*
*an error occurred:*
*boost::bad_any_cast: failed conversion using boost::any_cast*
*Callstack:*
*/home/va83ruvu/votca/share/votca/scripts/inverse/inverse.sh - linenumber
263*
* do_external - linenumber 175 in
/home/va83ruvu/votca/share/votca/scripts/inverse/functions_common.sh*
* /home/va83ruvu/votca/share/votca/scripts/inverse/update_ibi.sh -
linenumber 31*
* for_all - linenumber 22 (see 'csg_call --cat function
for_all')*
* do_external - linenumber 19 (see 'csg_call --cat
function do_external')*
*
/home/va83ruvu/votca/share/votca/scripts/inverse/calc_rdf_generic.sh -
linenumber 73*
* critical - linenumber 4 (see 'csg_call --cat
function critical')*
* die - linenumber 2 (see 'csg_call --cat
function die')*
*###############################################################################################################################################################################*
*#
#*
*# ERROR:
#*
*# critical: 'csg_stat --nt 64 --options
/home/va83ruvu/votca/src/csg-tutorials/spce/ibi_lammps/settings.xml --top
topol.xml --trj traj.dump --begin 0 --first-frame 0' failed #*
*# For details see the logfile
/home/va83ruvu/votca/src/csg-tutorials/spce/ibi_lammps/inverse.log
#*
*#
#*
*###############################################################################################################################################################################*
*die: (called from 48760) CSG_MASTER_PID is 46956*
*die: pids to kill: 46956 48524 48745 48760*
Cheers,
Vikram
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