Hi Petro, This should work (example with PDB 1ubq):
from pmg_tk.startup.apbs_gui.creating import pdb2pqr_cli from pmg_tk.startup.apbs_gui.electrostatics import map_new_apbs cmd.fetch("1ubq") pdb2pqr_cli("prepared01", "1ubq", options=["--ff", "amber"]) map_new_apbs("apbs_map01", "prepared01") cmd.ramp_new("apbs_ramp01", "apbs_map01", [-5, 0, 5]) cmd.set("surface_ramp_above_mode", 1, "prepared01") cmd.set("surface_color", "apbs_ramp01", "prepared01") cmd.show("surface", "prepared01") Tested with Incentive PyMOL 2.5.2 on Linux. Cheers, Thomas On Wed, May 17, 2023 at 4:51 PM Petro <subscr...@khoroshyy.net> wrote: > > Hi. > How can I generate electrostatics using Python API? > Thanks. > Petro. > _______________________________________________ > 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 _______________________________________________ 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