Re: [PyMOL] set_dihedral command

2006-11-14 Thread DeLano Scientific
; Of Abhinav Verma > Sent: Tuesday, November 14, 2006 6:07 AM > To: Chris Weichenberger; pymol-users@lists.sourceforge.net > Subject: Re: [PyMOL] set_dihedral command > > 1CRN for example has disulphide bonds which are covalant and > thats why set_dihedral does not work. I think its

Re: [PyMOL] set_dihedral command

2006-11-14 Thread Abhinav Verma
1CRN for example has disulphide bonds which are covalant and thats why set_dihedral does not work. I think its the bug, which tells you that it has been setted to zero. So you have to remove the disulphide bonds before setting the dihedral angles. you can do so by unbond r. cys and n. sg, r. cys

RE: [PyMOL] set_dihedral

2005-10-18 Thread Warren DeLano
> I guess that the moral of the story is that it's better to be > as specific as possible when making selections... Yes, this is an important thing to understand, and something I seen come up frequently with new users. The thing to remember is: As soon as you "create" a new object based on exis