Re: [gmx-users] Free energy calculation for aminoacids

2015-06-27 Thread Justin Lemkul
On 6/27/15 8:48 AM, Marzieh Saeedi Masineh wrote: Hi all I want to calculate free energy of solvation for a leucine and some other aminoacids individually,according to Justin tutorial : methane in the water. Is it reasonable to follow that method for free energy determination of one amino

[gmx-users] Free energy calculation for aminoacids

2015-06-27 Thread Marzieh Saeedi Masineh
Hi all I want to calculate free energy of solvation for a leucine and some other aminoacids individually,according to Justin tutorial : methane in the water. Is it reasonable to follow that method for free energy determination of one amino acid? Cheers body {height: 100%; color:#00; fo

[gmx-users] Free energy calculation for aminoacids

2015-06-27 Thread Marzieh Saeedi Masineh
Hi all I want to calculate free energy of solvation for a leucine and some other aminoacids individually,according to Justin tutorial : methane in the water. Is it reasonable to follow that method for free energy determination of one amino acid? Cheers -- Gromacs Users mailing list * Pleas