Re: [gmx-users] how to extract individual frames from trajectory

2013-04-19 Thread Justin Lemkul
On 4/19/13 8:03 AM, aixintiankong wrote: At 2013-04-14 11:07:39,aixintiankong wrote: Dear, I have made a 10ns prodution MD, I want to extract frames from the molecular dynamics simulations at regular intervals of 10ps and keep the file as individual pdb file. The dt=0.002,n

[gmx-users] how to extract individual frames from trajectory

2013-04-19 Thread aixintiankong
At 2013-04-14 11:07:39,aixintiankong wrote: Dear, I have made a 10ns prodution MD, I want to extract frames from the molecular dynamics simulations at regular intervals of 10ps and keep the file as individual pdb file. The dt=0.002,nstxtcout = 500,i want to use the follow comm

Re: [gmx-users] how to extract individual frames from trajectory

2013-04-13 Thread Justin Lemkul
On 4/13/13 11:07 PM, aixintiankong wrote: Dear, I have made a 75ns prodution MD, I want to extract frames from the molecular dynamics simulations at regular intervals of 10ps and keep the file as individual pdb file. i want get many individual pdb files. colud anyone can tell

[gmx-users] how to extract individual frames from trajectory

2013-04-13 Thread aixintiankong
Dear, I have made a 75ns prodution MD, I want to extract frames from the molecular dynamics simulations at regular intervals of 10ps and keep the file as individual pdb file. i want get many individual pdb files. colud anyone can tell me how to perform the command? thank you ! -- gm