REMC hippo_input

Discussions on how to set up simulations, typically starting from a pdb file.
sitiazma
Posts: 11
Joined: Tue Sep 15, 2009 12:29 pm

Re: REMC hippo_input

Post by sitiazma » Thu Sep 24, 2009 4:14 pm

Hi

Actually I also have played around with the many commands from the mpd including the mpdboot. At the moment there is still no success yet. I hope I am not yet give up to test your program. If you come across to have any suggestion, please advise.

Best regards.

martin
Developer
Posts: 38
Joined: Sun Jun 15, 2008 10:27 pm

Re: REMC hippo_input

Post by martin » Thu Oct 01, 2009 4:27 pm

Hi,

I've looked and not found a solution yet. I think this is an MPI problem, and unfortunately i'm not an expert on MPI. I'll let you know if i have any more suggestions, for the moment i would recommend just running high temperature MC. That is usually quite efficient as well.
Good luck!
Best wishes,
Martin

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