Dear Users,
I would like to convert my psf file generated by VMD (psfgen) to
amber style format. I am using AMBER12 with AmberTools 14.
Unfortunately, I obtained the following error:
===========================================================
PSF input parsing summary
===========================================================
Number of PSF flags found: 1
Number of atoms
found: 24
Number of residues found: 1
Number of bonds found: 24
Number of angles found: 42
Number of dihedrals found: 54
Number of impropers found: 0
Number of donors found: 0
Number of acceptors found: 0
Number of explicit nonbonded exclusions found: 0
Number of groups found: 0
Number of ST2 waters found: 0
===========================================================
At line 292 of file psfprm.F90
Fortran runtime error: Bad value during integer read
I have attached here my psf (my_mol.psf) file.
Please advise.Thanks in advance.
Shubhadip Das
Phd Research Scholar
Depeartment of Chemistry
IIT Guwahati
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Received on Sun Oct 26 2014 - 21:30:02 PDT
