Re: [gmx-users] POPC Berger lipids parameters for AMBER99sb

2019-07-09 Thread Justin Lemkul
On 7/9/19 2:59 AM, Carlos Navarro wrote: Dear Justin, Thanks for the reply. I forgot to mention that indeed the reason of using Berger lipids is because there are united-atom. I'm planning on running computational electrophysiology simulations, and since my system is about 600k atoms I want

Re: [gmx-users] POPC Berger lipids parameters for AMBER99sb

2019-07-09 Thread Carlos Navarro
Dear Justin, To use a time step of 4fs(i clicked send by.mistake) On Tue, Jul 9, 2019 at 7:59 AM Carlos Navarro wrote: > Dear Justin, > Thanks for the reply. > I forgot to mention that indeed the reason of using Berger lipids is > because there are united-atom. I'm planning on running

Re: [gmx-users] POPC Berger lipids parameters for AMBER99sb

2019-07-09 Thread Carlos Navarro
Dear Justin, Thanks for the reply. I forgot to mention that indeed the reason of using Berger lipids is because there are united-atom. I'm planning on running computational electrophysiology simulations, and since my system is about 600k atoms I want to use vsites, as De Groot has been doing

Re: [gmx-users] POPC Berger lipids parameters for AMBER99sb

2019-07-08 Thread Justin Lemkul
On 7/8/19 7:31 PM, Carlos Navarro wrote: Dear gmx-users, I was wondering if someone can share the Berger parameters for POPC for Amber99sb (and I they can share also a .pdb .gro file will be even better). I found several for gromos, but I need them form AMBER99sb. Berger parameters are

[gmx-users] POPC Berger lipids parameters for AMBER99sb

2019-07-08 Thread Carlos Navarro
Dear gmx-users, I was wondering if someone can share the Berger parameters for POPC for Amber99sb (and I they can share also a .pdb .gro file will be even better). I found several for gromos, but I need them form AMBER99sb. Best regards, Carlos —— Carlos Navarro Retamal Bioinformatic