Re: [gmx-users] g_hbond never shows hbond with HW2

2015-05-01 Thread Ebert Maximilian
Thanks Justin. I just found out myself and wanted to answer my own question. But you are just too fast. Have a good one, Max > On May 1, 2015, at 11:30 AM, Justin Lemkul wrote: > > > > On 5/1/15 11:27 AM, Ebert Maximilian wrote: >> Dear list, >> >> I discovered something strange today. In

Re: [gmx-users] g_hbond never shows hbond with HW2

2015-05-01 Thread Justin Lemkul
On 5/1/15 11:27 AM, Ebert Maximilian wrote: Dear list, I discovered something strange today. In my hbond search i find only HW1 of the water forming a hydrogen bond as donor hydrogen and never HW2. Is this due to the fact that I am using SPC water? I can see the atom IDs of HW2 in the [ don

[gmx-users] g_hbond never shows hbond with HW2

2015-05-01 Thread Ebert Maximilian
Dear list, I discovered something strange today. In my hbond search i find only HW1 of the water forming a hydrogen bond as donor hydrogen and never HW2. Is this due to the fact that I am using SPC water? I can see the atom IDs of HW2 in the [ donors_hydrogens_Water ] entry in the ndx file. So