feenstra at chem.vu.nl
Wed Jan 14 13:58:05 CET 2004
Nguyen Hoang Phuong wrote:
>>Quick question..even though i've been using GROMACS for a while now!
>>Is there anyway I can calculate the pH of a peptide in GROMACS????
>>Pretty sure there's nothing about that in the manual.
> I think this question was answered in detail by Baptista. You should
> search the list.
For a short answer: no.
>>PS. Are there any plans to setup a GROMACS users symposium,say in Gronigen,
>>where it all started! There are quite a few users now and will def. help the
>>exchange of ideas etc.
There are (or have been?) plans at some point(s) in time, at least for a
workshop of some sort, but nothing concrete up to now. I agree it would be
nice, and my feeling is there would be much interest in it. I'll fork this
into a new thread and see if (enough) people get enthousiastic...
| | |
| _ _ ___,| K. Anton Feenstra |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
|( | )| | | De Boelelaan 1083 - 1081 HV Amsterdam - Netherlands |
| \_/ \_/ | | | Tel: +31 20 44 47608 - Fax: +31 20 44 47610 |
| | Feenstra at chem.vu.nl - www.chem.vu.nl/~feenstra/ |
| | "If You See Me Getting High, Knock Me Down" |
| | (Red Hot Chili Peppers) |
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