Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-09 Thread Navneet Kumar
Thankyou! On Fri, Jan 10, 2020 at 6:00 AM Justin Lemkul wrote: > > > On 1/9/20 9:42 AM, Navneet Kumar wrote: > > Thank You, sir! > > > > What If I want to extend the residues like choose c-alpha of 150-200 & > > 60-70 in a single index group ? > > 3 & r 60-70 | 3 & r 150-200 > > Type "help" at

Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-09 Thread Justin Lemkul
On 1/9/20 9:42 AM, Navneet Kumar wrote: Thank You, sir! What If I want to extend the residues like choose c-alpha of 150-200 & 60-70 in a single index group ? 3 & r 60-70 | 3 & r 150-200 Type "help" at the make_ndx prompt for examples of how to use the program. -Justin On Wed, Jan 8,

Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-09 Thread Navneet Kumar
Thank You, sir! What If I want to extend the residues like choose c-alpha of 150-200 & 60-70 in a single index group ? On Wed, Jan 8, 2020 at 6:21 PM Justin Lemkul wrote: > > > On 1/8/20 4:49 AM, Christian Blau wrote: > > Hi Navnett, > > > > > > gmx select will be your friend. > > > > > > At

Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-08 Thread Justin Lemkul
On 1/8/20 4:49 AM, Christian Blau wrote: Hi Navnett, gmx select will be your friend. At the bottom of http://manual.gromacs.org/documentation/current/onlinehelp/selections.html you'll find some example commands. Something along the lines of   gmx select -select 'name CA and resid >

Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-08 Thread Navneet Kumar
Thank You, Sir! On Wed, Jan 8, 2020 at 3:19 PM Christian Blau wrote: > Hi Navnett, > > > gmx select will be your friend. > > > At the bottom of > > http://manual.gromacs.org/documentation/current/onlinehelp/selections.html > > you'll find some example commands. Something along the lines of > >

Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-08 Thread Christian Blau
Hi Navnett, gmx select will be your friend. At the bottom of http://manual.gromacs.org/documentation/current/onlinehelp/selections.html you'll find some example commands. Something along the lines of   gmx select -select 'name CA and resid > 149 and resid < 211' should work. It's a very

Re: [gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-08 Thread Navneet Kumar
Sorry, it should be 150-200 residues. On Wed, Jan 8, 2020 at 3:09 PM Navneet Kumar wrote: > Hello Everyone! > > > How to create an index group for Backbone/C-alpha for a specific set of > residues from protein? (Say Protein with 200 amino acid; want to create an > index group for the backbone

[gmx-users] Index group for Backbone/C-alpha of specific stretch of residues

2020-01-08 Thread Navneet Kumar
Hello Everyone! How to create an index group for Backbone/C-alpha for a specific set of residues from protein? (Say Protein with 200 amino acid; want to create an index group for the backbone of residues 150-210). Regards Navneet Kumar -- Gromacs Users mailing list * Please search the archive