[gmx-users] Hydrogen existence time

aiswarya.pawar at gmail.com aiswarya.pawar at gmail.com
Wed Aug 24 14:31:12 CEST 2011


Any idea how can I calculate the residence time of water.

Aiswarya
------Original Message------
From: Justin A. Lemkul
To: Aiswarya Pawar
To: Gromacs mail
ReplyTo: jalemkul at vt.edu
Subject: Re: [gmx-users] Hydrogen existence time
Sent: 24 Aug 2011 5:58 PM



aiswarya.pawar at gmail.com wrote:
> Dear Justin,
> 
> So what does the hydrogen bond existence state?
> 

The length of time for which a given hydrogen bond exists (i.e. satisfies the 
geometrical criteria in the context of some particular partner group).

-Justin

> Thanks
> ------Original Message------
> From: Justin A. Lemkul
> To: Aiswarya Pawar
> To: Gromacs mail
> ReplyTo: jalemkul at vt.edu
> Subject: Re: [gmx-users] Hydrogen existence time
> Sent: 24 Aug 2011 5:54 PM
> 
> 
> 
> aiswarya.pawar at gmail.com wrote:
>> Dear all,
>>
>> Does Hydrogen bond existence in a time frame states the residence time of the water molecule?
>>
> 
> Not necessarily, no.
> 
> -Justin
> 
> 

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

========================================

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