Re: [gmx-users] Bins in wham analysis

2012-07-26 Thread lloyd riggs
the sham? Does anyone know why? Stephan Watkins Original-Nachricht > Datum: Thu, 26 Jul 2012 06:46:04 -0400 > Von: Justin Lemkul > An: Discussion list for GROMACS users > Betreff: Re: [gmx-users] Bins in wham analysis > > > On 7/26/12 3:55 AM, neeru s

Re: [gmx-users] Bins in wham analysis

2012-07-26 Thread Justin Lemkul
On 7/26/12 3:55 AM, neeru sharma wrote: Dear Gromacs users, I have a query regarding the number of bins used in wham analysis. If I have performed by simulations over 15 umbrellas (15 different staring structures), what should be the ideal number of bins to perform wham analysis? Does it depe

[gmx-users] Bins in wham analysis

2012-07-26 Thread neeru sharma
Dear Gromacs users, I have a query regarding the number of bins used in wham analysis. If I have performed by simulations over 15 umbrellas (15 different staring structures), what should be the ideal number of bins to perform wham analysis? Does it depend on the number of umbrellas. For example:

[gmx-users] Bins in wham analysis

2012-07-24 Thread neeru sharma
Dear Gromacs users, I have a query regarding the number of bins used in wham analysis. If I have performed by simulations over 15 umbrellas (15 different staring structures), what should be the ideal number of bins to perform wham analysis? Does it depend on the number of umbrellas. For example: