mg-para — APBS-PDB2PQR 1.6 documentation

# mg-para

Automatically-configured parallel focusing multigrid Poisson-Boltzmann calculations.

This calculation closely resembles mg-auto in syntax. However, it is designed to perform electrostatics calculations on systems in a parallel focusing fashion.

ELEC mg-para keywords:

- async
- bcfl
- calcenergy
- calcforce
- cgcent
- cglen
- chgm
- dime
- etol
- fgcent
- fglen
- ion
- lpbe
- lrpbe
- mol
- npbe
- ofrac
- pdie
- pdime
- sdens
- sdie
- srad
- srfm (elec)
- swin
- temp
- usemap
- write
- writemat