[gmx-users] problem with MD
feenstra at chem.vu.nl
Mon Nov 3 09:38:01 CET 2003
> I know that it is hard to rectify such problem with such a short description, however, I will appreciate it if you could kindly let me know what is the problem.
Did you first do (in this order): EM and MD with position restraints?
Where there any problems/errors/warnings/strange things during that?
| | |
| _ _ ___,| K. Anton Feenstra |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
|( | )| | | De Boelelaan 1083 - 1081 HV Amsterdam - Netherlands |
| \_/ \_/ | | | Room P275 Tel: +31 20 44 47608 Fax: +31 20 44 47610 |
| | Feenstra at chem.vu.nl - www.chem.vu.nl/~feenstra/ |
| | "Everybody is Smashing Things Down" (Offspring) |
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