[gmx-users] Error with tabulated potential and tip4p water model

Udaya Dahal dahal.udaya at gmail.com
Sun Aug 3 18:56:54 CEST 2014


 I have tabulated potential for all the possible combinations(non bonded).
I am using Tip4p water model for the polymer water interaction. While
running the energy minimization i got the error like below.

Fatal error:
Settle block crossing node boundaries
constraint between atoms 664, 665, 666)
For more information and tips for troubleshooting, please check the GROMACS
website at http://www.gromacs.org/Documentation/Errors

Any idea to slove this issue.?

Thank you,
Udaya.


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