Re: [PyMOL] Minimum mesh spacing

2019-05-03 Thread Thomas Holder
Hi Vatsal, The "min_mesh_spacing" setting only affects the "mesh" representation of molecules (molecular surface). To increase the mesh density of an isomesh, you need to upsample the map with the "map_double" command. https://pymolwiki.org/index.php/Map_Double Hope that helps. Cheers,

Re: [PyMOL] Electron density map color

2019-05-03 Thread Thomas Holder
Hi Vatsal, This is how you show positive and negative contour: fetch 1ubq, diffmap, type=fofc, async=0 isomesh diffmesh, diffmap, 3.0 color green, diffmesh set mesh_negative_color, red set mesh_negative_visible Example copied from: https://pymolwiki.org/index.php/mesh_negative_visible Cheers,

Re: [PyMOL] monitor same protein conformational change with multiple trajectory files

2019-05-03 Thread Thomas Holder
Hi Yu and David, I like to throw in one of the many ways to do this inside PyMOL :-) from pymol import cmd # load 3000 files into the "multi" object for i in range(3000): cmd.load('file_{}.pdb'.format(i + 1), 'multi') # if you want, fit to the first state cmd.intra_fit('multi') Morphing between