ELECTROSTATICS

• (commands from TRACE & SECONDARY STRUCTURE & SURFACES)
• Front panel: Tools ==> Compute Electrostatic Potential

• Front panel: File ==> Save ==> Potential (1ATP.pot)
• Front panel: File ==> Discard ==> Electrostatic Potential

• Front panel: Prefs ==> Electrostatic potential

• Front panel: Tools ==> Compute Molecular Surface

Molecular surface with an electrostatic potential
As default, only charged residues (Arg, Lsy, Glu, Asp) are taken into account,
and the charges are located at the corresponding  (non-H) atom positions.
 

• Front panel: Discard ==> Surface
• Front panel: File ==> Close