Re: [PyMOL] how to measure the distance of 2 hydrophobic residues

2015-07-09 Thread Sampson, Jared
Hi Smith - This won't tell you anything about the hydrophobic interaction itself, but if you want to get the distance between the average positions (like center of mass, but without mass) of two groups of atoms to use as an "approximate" distance between the two residues/sidechains/etc., you ca

Re: [PyMOL] how to measure the distance of 2 hydrophobic residues

2015-07-08 Thread Osvaldo Martin
Hi Smith, Distances are generally defined for two points (although it is possible to generalize the idea to higher dimensions). Since residues are 3D objects, there is not such a thing as THE distance between 2 residues. Being said that, as we generally model residues as a collection of spheres (a

Re: [PyMOL] how to measure the distance of 2 hydrophobic residues

2015-07-08 Thread Smith Liu
Dear Osvaldo, I want to know whether hydrophobic interactions between 2 residues exist, thus I want know the distance between the 2 residues, rather than the distance between the atom of each of the 2 residues. Is any sense and method we measure the distance between 2 residues? Best regard

Re: [PyMOL] how to measure the distance of 2 hydrophobic residues

2015-07-08 Thread Shane Caldwell
2 ways: On the menu: Wizard --> Measurement --> click atom 1 --> click atom 2 On the prompt: distance [selection of atom 1], [selection of atom 2] Shane Caldwell McGill University On Wed, Jul 8, 2015 at 11:33 AM, Smith Liu wrote: > Dear All, > > Pymol has the function to measure the distanc

Re: [PyMOL] how to measure the distance of 2 hydrophobic residues

2015-07-08 Thread Osvaldo Martin
Hi Smith, If you want to measure the distance between two residues (hydrophobic or not) you could choose and atom from each residue and measure the distance between those two atoms. Is this what you want to do, or something more complex? Could you provide more details about your problem? Cheers

[PyMOL] how to measure the distance of 2 hydrophobic residues

2015-07-08 Thread Smith Liu
Dear All, Pymol has the function to measure the distance betweeen 2 atoms. In addition, if 2 hydrophobic residues are close enough, there will be hydrophobic interactions betweem them. But will you please tell me how to measure the distance between 2 hydrophobic residues by pymol? Best regar