scnb value to prevent VDWs scaling

From: Marc Gordon (marcgrdn55_at_gmail.com)
Date: Mon Aug 13 2012 - 08:40:13 CDT

• Next message: JC Gumbart: "pressure profile calculations"
• Previous message: Axel Kohlmeyer: "Re: 1-4 vdw scaling?"
• Next in thread: Marc Gordon: "Re: scnb value to prevent VDWs scaling"
• Reply: Marc Gordon: "Re: scnb value to prevent VDWs scaling"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

Hi all

I'm trying to find out what scnb figure in NAMD results in no scaling. I
gather from the user guide that the default is 2 and that the VDWs
interactions are divided by the scnb value.

It seems to me that an scnb value of 1 would then be required to achieve no
scaling (or a scaling factor of 1 anyway) of VDWs interactions. Just
thought I would check. Am I correct in this?

Regards
Marc

• Next message: JC Gumbart: "pressure profile calculations"
• Previous message: Axel Kohlmeyer: "Re: 1-4 vdw scaling?"
• Next in thread: Marc Gordon: "Re: scnb value to prevent VDWs scaling"
• Reply: Marc Gordon: "Re: scnb value to prevent VDWs scaling"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

This archive was generated by hypermail 2.1.6 : Tue Dec 31 2013 - 23:22:23 CST