[gmx-users] (no subject)
Kingsley Theras Primus Dass .
105726107 at gms.tcu.edu.tw
Tue Nov 1 13:14:04 CET 2016
Hello !
As I am new to this field , I have some doubts . I want to sulfate the
tyrosine residue in the chemokine receptor ...
But wen I download a pdb file that has sulfated tyrosine residue and run
pdb2gmx command in GROMACS ,it is showing a error message ...how can i come
over this problem
Program pdb2gmx, VERSION 4.6.1
Source code file:
/home/abuild/rpmbuild/BUILD/gromacs-4.6.1/src/kernel/resall.c, line: 642
Fatal error:
Residue 'TYS' not found in residue topology database
For more information and tips for troubleshooting, please check the GROMACS
website at http://www.gromacs.org/Documentation/Errors
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