Main class which owns all subgroups : protein and sogrid, see UMLshema_archi. More...

Collaboration diagram for mod_array_protein::array_protein_type:

Public Attributes
type(protein), dimension(:), pointer	array
	array of pointers to proteins, not so convenient in case of muVT extension
integer	nb_grids
	Total number of grids ( as given in sda_input ) Count for different types, flexible conformations not accounted here but in flexible.
integer, dimension(:, :), pointer	set_of_protein
	store relation prot-grid in an array of size ( nb_grids, 2 ) : type number, [first prot, last prot]
integer	size_metal

Detailed Description

Main class which owns all subgroups : protein and sogrid, see UMLshema_archi.

Its copy/deletion will assure correct copy/deletion of the subgroups

Store pointers to all proteins
Store the type of the solute in set_of_protein eg : prot 1 - 5 type 1 ( associated to sogrid/plist_flex 1 ), prot 6 10 type 2 ( with sogrid/plist_flex 2 )

Member Data Documentation

◆ array

type ( protein ), dimension ( : ), pointer mod_array_protein::array_protein_type::array

array of pointers to proteins, not so convenient in case of muVT extension

◆ nb_grids

integer mod_array_protein::array_protein_type::nb_grids

Total number of grids ( as given in sda_input )
Count for different types, flexible conformations not accounted here but in flexible.

◆ set_of_protein

integer, dimension ( :, : ), pointer mod_array_protein::array_protein_type::set_of_protein

store relation prot-grid in an array of size ( nb_grids, 2 ) : type number, [first prot, last prot]

◆ size_metal

integer mod_array_protein::array_protein_type::size_metal

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

mod_array_protein.f90