Convert APBS OpenDX Grid to XYZ Format

[sbembenek18]

I'm trying to convert the APBS OpenDX grid to XYZ format along with the electrostatic potential value. This would be useful for other calculations I want to do.

Has anyone done this before?

[sobolevnrm]

Hello --

The code that should help you do this is available at

apbs/src/mg/vgrid.c

Line 179 in c2e5af2

VPUBLIC int Vgrid_value(Vgrid *thee, double pt[3], double *value) {

.

Thanks,

Nathan

[sbembenek18]

Thanks!