Re: [gmx-users] Vmd error

2017-06-16 Thread Nikhil Maroli
Hi, You have to load the .gro file which is corresponding to the trajectory. If you're following the tutorial and the naming convention the file you supposed to load prior to trajectory is npt.gro. If it is something else- VMD will tell you the exact problem as Justin pointed out. -- Gromacs User

Re: [gmx-users] Vmd error

2017-06-16 Thread Justin Lemkul
On 6/16/17 6:12 AM, Quyen V. Vu wrote: Hi there I extended my simulation of a free protein from 100ns to 150ns. Corresponding files are extend.gro and extend.xtc. I applied pbc conditions and my new xtc s newmd.xtc. I tried to visualise my trajectory in vmd I uploaded the extend.gro file a

Re: [gmx-users] Vmd error

2017-06-16 Thread Justin Lemkul
On 6/16/17 12:33 AM, RAHUL SURESH wrote: I extended my simulation of a free protein from 100ns to 150ns. Corresponding files are extend.gro and extend.xtc. I applied pbc conditions and my new xtc s newmd.xtc. I tried to visualise my trajectory in vmd I uploaded the extend.gro file and loaded

Re: [gmx-users] Vmd error

2017-06-16 Thread Quyen V. Vu
Hi there > > I extended my simulation of a free protein from 100ns to 150ns. > Corresponding files are extend.gro and extend.xtc. > I applied pbc conditions and my new xtc s newmd.xtc. > > I tried to visualise my trajectory in vmd > > I uploaded the extend.gro file and? loaded newmd.xtc in gro fil

Re: [gmx-users] Vmd error

2017-06-16 Thread Emran Heshmati
To: "gmx-us...@gromacs.org" Sent: Friday, 16 June 2017, 9:04 Subject: [gmx-users] Vmd error I extended my simulation of a free protein from 100ns to 150ns. Corresponding files are extend.gro and extend.xtc. I applied pbc conditions and my new xtc s newmd.xtc. I tried

[gmx-users] Vmd error

2017-06-15 Thread RAHUL SURESH
I extended my simulation of a free protein from 100ns to 150ns. Corresponding files are extend.gro and extend.xtc. I applied pbc conditions and my new xtc s newmd.xtc. I tried to visualise my trajectory in vmd I uploaded the extend.gro file and loaded newmd.xtc in gro file. But I couldn't visual