Hello, everyone!
When run "$AMBERHOME/exe/mm_pbsa.pl binding_energy.mmpbsa", I found this
err as below:
#################################################################
=>> Calculating energy / entropy contributions
Calc contrib for ./snapshot_com.crd.1
Calc MM/GB/SAS
Generate PDB
Center PDB
Calc PBSA
Generate PQR
No radius found for 'H5* 3835 in residue SAM 251
Died at /home/john/soft/amber10/src/mm_pbsa/mm_pbsa_calceneent.pm line 660, <PDB> line 3837.
########################################################################
But I have run much time, I do not want to run again.
Could somebody tell me how to retrieve this errs?
Thanks very much!
javacfish
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Received on Mon Mar 08 2010 - 07:00:04 PST
