Re: AMBER: intramolecular nonbonded interactions in AMBER force field

From: Vineet Pande <pande_vineet.hotmail.com>
Date: Thu, 21 Apr 2005 13:26:30 +0000

Dear Prof. Simmerling:
Page 109 and 110 of Amber 8 manual "...Thus the amber mask list is rebuilt
from these 1-1, 1-2, 1-3,
and 1-4 pairs......"
1-3 and 1-4 are understandable...as nonbonded pairs but 1-1 and 1-2 then
correspond to self and bonded interaction?? whats the relevance)
Thanks!
Vineet
>
>I searched the amber 8 manual lfor "1-1" and found nothing.
>What page is this on? I'll look at it and see if I can help explain it.
>Carlos
>
>>>
>>May I comment here and also ask one question related...When we say 1-4
>>nonbonded interactions its clear what it means but when we say 1-1
>>nonbonded interactions (as it is in AMBER manual) what does it mean?
>>Cheerio
>>Vineet.
>>
>>_________________________________________________________________
>>
>
>-----------------------------------------------------------------------
>The AMBER Mail Reflector
>To post, send mail to amber.scripps.edu
>To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu

_________________________________________________________________
Express yourself instantly with MSN Messenger! Download today it's FREE!
http://messenger.msn.click-url.com/go/onm00200471ave/direct/01/

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Thu Apr 21 2005 - 14:53:01 PDT
Custom Search