Dear AMBERs,
has anybody an idea how to measure a volume of the cavity inside protein
along MD trajectry?
Thank you very much in advance, Michal Otyepka
*---------------------------------------------[*]-*
| Department of Inorganic and Physical Chemistry |
| Palacky University |
| tr. Svobody 26, 771 46 Olomouc, Czech Republic |
| |
|ph. +420 68 5222451 (+396) fax +420 68 522 5737|
| fax +420 68 563 4420|
|
http://aix.upol.cz/~otyepka |
|
http://www.upol.cz/kafch |
*-------------------------------------------------*
From cieplak_at_tiger.chem.uw.edu.pl 22 Feb 2001 10:28:14 -0000
Message-id: <20010222102814.8781.qmail.tiger.chem.uw.edu.pl>
Date: 22 Feb 2001 10:28:14 -0000
From: cieplak_at_tiger.chem.uw.edu.pl <cieplak_at_tiger.chem.uw.edu.pl>
To: AMBER list <amber.heimdal.compchem.ucsf.edu>
Subject: Re: belly run
In-Reply-to: <belly run>
Mysle, ze trzeba nakladac na siebie tylko te czesci , ktore sa poza belly,
czyli sie nie ruszaja, a nie cale czasteczki. Poza belly - sily sa zerowane.
Best
Piotr
Received on Wed Feb 21 2001 - 12:23:01 PST
