[gmx-users] No default U-B types
라지브간디
rajiv at kaist.ac.kr
Tue Mar 12 14:26:19 CET 2013
Dear gmx users.
I have specified the bond line for heme with CO ligand in specbond.dat and it created topology with special bond in bond type. However, when i come to the steps of atomic-level description of our system in the binary file using ions.tpr, i got an following error.
ERROR 1 [file topol_Other_chain_A2.itp, line 265]:
No default U-B types
ERROR 2 [file topol_Other_chain_A2.itp, line 343]:
No default U-B types
How do i avoid this error ? Thanks in advance.
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