Define tyoe analytic interactions (Debye-Huckel/crowders) More...

Collaboration diagram for mod_analytic::analytic:

Public Attributes

real(kind=8), dimension(:,:), pointer	parray_nrj
	define the arrays to store energy of interaction and force Could use 2 dimension array, to store for different types / stoke_radius More...

real(kind=8), dimension(:,:), pointer	parray_force

integer	type
	type of the array More...

integer	nbbin
	Array properties, nbbin. More...

real(kind=8)	max_size

real(kind=8)	h

real(kind=8)	stoke_radius
	1 solute representation, already in protein a bit useless becasue need the sum of the radius More...

real(kind=8)	ki
	Store ki, bjerrum usefull quantity independent of stoke radius. More...

real(kind=8)	bjerrum

real(kind=8)	ionic

integer	nbtypes
	Number of different types of solutes. More...

Detailed Description

Define tyoe analytic interactions (Debye-Huckel/crowders)

Member Data Documentation

◆ bjerrum

real ( kind=8 ) mod_analytic::analytic::bjerrum

◆ h

real(kind=8) mod_analytic::analytic::h

◆ ionic

real ( kind=8 ) mod_analytic::analytic::ionic

◆ ki

real ( kind=8 ) mod_analytic::analytic::ki

Store ki, bjerrum usefull quantity independent of stoke radius.

◆ max_size

real(kind=8) mod_analytic::analytic::max_size

◆ nbbin

integer mod_analytic::analytic::nbbin

Array properties, nbbin.

◆ nbtypes

integer mod_analytic::analytic::nbtypes

Number of different types of solutes.

◆ parray_force

real(kind=8), dimension(:,:), pointer mod_analytic::analytic::parray_force

◆ parray_nrj

real(kind=8), dimension(:,:), pointer mod_analytic::analytic::parray_nrj

define the arrays to store energy of interaction and force Could use 2 dimension array, to store for different types / stoke_radius

◆ stoke_radius

real(kind=8) mod_analytic::analytic::stoke_radius

1 solute representation, already in protein a bit useless becasue need the sum of the radius

◆ type

integer mod_analytic::analytic::type

type of the array

The documentation for this type was generated from the following file:

mod_analytic.f90

Public Attributes