Membrane permeability

Membrane permeability:
Calculates an estimated passive membrane permeability for a ligand structure by comparing the energy optimized conformations of that ligand in low and high dielectric.
Calculates the amphipilic moment of positively charged molecules.

Author: Schrodinger

Input ports

1. Type: Table
   Input data table containing molecules in Maestro format
   Maestro format

Output ports

1. Type: Table
   Permeability properties
   Extracted properties
2. Type: Table
   Molecules in Maestro format
   Output structures
3. Type: Table
   Log
   Log file