Hi Thomas, Thank you for your reply. I made the cube file by using psi4 which is one of quantum chemistry package. I will check the file.
Kind regards, Taka 2019年6月11日(火) 19:40 Thomas Holder <thomas.hol...@schrodinger.com>: > Hi Taka, > > Your ESP.cube file doesn't look like an electrostatic potential map, it > looks like electron density. You need two map files, one for the density, > and one for the ESP. > > Cheers, > Thomas > > > On Jun 8, 2019, at 12:39 AM, Taka Seri <serit...@gmail.com> wrote: > > > > Dear Pymol users, > > I am newbie of Pymol. > > I have a question of coloring method. I would like to draw isosurface > with ESP and would like to set color with ramp_new function. > > Attached files are example. > > When I load ESP file and type following command, I could get isosurface. > > But I could get only blue colored surface after setting color with > ramp_new function. > > > > > isosurface esp_surf, ESP, 0.2 > > > ramp_new color_map, ESP, [-0.1, 0.1] > > > > I read following url and it worked well. > > https://pymolwiki.org/index.php/Ramp_New > > > > Is something wrong in my ESP file or approach? Any advice or suggestions > will be greatly appreciated. > > > > Kind regards, > > > > Taka > > <ESP.cube>_______________________________________________ > > PyMOL-users mailing list > > Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net > > Unsubscribe: > https://sourceforge.net/projects/pymol/lists/pymol-users/unsubscribe > > -- > Thomas Holder > PyMOL Principal Developer > Schrödinger, Inc. > >
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