Re: [gmx-users] autocorrelation functions

On 5/04/2011 2:55 AM, shivangi nangia wrote: Hello all, I need to calculate the end-to-end vector autocorrelation function of my polymer chains. I could get the velocity autocorrelation function using g_velacc tool. Is there a tool available for calculating end-to-end vector autocorrelati

[gmx-users] autocorrelation functions

Hello all, I need to calculate the end-to-end vector autocorrelation function of my polymer chains. I could get the velocity autocorrelation function using g_velacc tool. Is there a tool available for calculating end-to-end vector autocorrelation function? If not, then is there an easy way to mo

[gmx-users] autocorrelation functions

Hello all, I need to calculate the end-to-end vector autocorrelation function of my polymer chains. I could get the velocity autocorrelation function using g_velacc tool. Is there a tool available for calculating end-to-end vector autocorrelation function? If not, then is there an easy way to m

[gmx-users] autocorrelation functions from several simulations d

Hi all, I have some doubts regarding the general use of acfs. The molecule I am studying is formed by two polycyclic aromatic sub-units joined by a 20-alkene "chain"; it is something like this: /--\/--\ /--\/--\ A | | |-CH2-CH-CH2-CH-CH2(...)| | | B \--/\--/