From: Buddhadev Maiti (chebm_at_langate.gsu.edu)
Date: Thu Mar 17 2011 - 21:46:37 CDT
Dear NAMD Users,
For ABF restart, I added the following lines in input file. Could you please suggest me whether is it correct or not, it will be great help for me. prod1 and pord2 are old and new run. Distance.in is the ABF defined parameter file. From old run, which file do I need to add among the prod1.colvars.state and prod1-restart.colvars.state files in colvarsInput. Basically two files are same. Do I need to add more files or not.
Have a nice day,
Thanks,
Maiti
set runnew prod2
set runold prod1
bincoordinates ./${runold}-restart.coor
binvelocities ./${runold}-restart.vel
extendedSystem ./${runold}-restart.xsc
colvars on
colvarsInput ./${runold}.colvars.state
colvarsConfig Distance.in
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