[gmx-users] could not write energies: Invalid argument

[Anton Feenstra]

Albert Sun wrote:

> Dear USERS,
> 
> I met two problems with messages: 
> 
> 1) Fatal error: could not write energies: Invalid argument 

? Tell me more ?

> 2) Warning: pressure scaling more than 1%, mu: 1 1 1.01293
> I belived this could be due to tau_p was too small, but it did not help after increase tau_p to  5.0.  

Badly equilibrated system? Try (more) em, try md without p-coupl first,
check your density, check if system doesn't heat up (you have no t-coupl!)


-- 
Groetjes,

Anton
  _____________ _______________________________________________________
|             |                                                       |
|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
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| \_/ \_/ | | | Tel: +31 20 44 47608 - Fax: +31 20 44 47610           |
|             | Feenstra at chem.vu.nl - www.chem.vu.nl/~feenstra/       |
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