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Hi,<br><br>There are automatically different, since they are based on the A and B state charges<br>and the A and B state atom types.<br><br>Berk<br><br>> Date: Thu, 19 Nov 2009 16:15:52 +0100<br>> From: jochen@xray.bmc.uu.se<br>> To: gmx-users@gromacs.org<br>> Subject: [gmx-users] FEP with bond formation, pair problem<br>> <br>> Hi,<br>> <br>> how can I use different coulomb 1-4 interactions in the A and B state. <br>> The Manual just says<br>> <br>> [ pairs ] : LJ and Coulomb 1-4 interactions<br>> <br>> but, I far as I could see, did not give an example how the coulomb 1-4 <br>> interaction can be explicitly given.<br>> <br>> Thanks a lot for any help,<br>> <br>> Jochen<br>> <br>> <br>> -- <br>> ---------------------------------------------------<br>> Dr. Jochen Hub<br>> Molecular Biophysics group<br>> Dept. of Cell & Molecular Biology<br>> Uppsala University. Box 596, 75124 Uppsala, Sweden.<br>> Phone: +46-18-4714451 Fax: +46-18-511755<br>> ---------------------------------------------------<br>> <br>> -- <br>> gmx-users mailing list gmx-users@gromacs.org<br>> http://lists.gromacs.org/mailman/listinfo/gmx-users<br>> Please search the archive at http://www.gromacs.org/search before posting!<br>> Please don't post (un)subscribe requests to the list. Use the <br>> www interface or send it to gmx-users-request@gromacs.org.<br>> Can't post? Read http://www.gromacs.org/mailing_lists/users.php<br> <br /><hr />Express yourself instantly with MSN Messenger! <a href='http://clk.atdmt.com/AVE/go/onm00200471ave/direct/01/' target='_new'>MSN Messenger</a></body>
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