rmsd_config Module

  1. config.f90
  2. rmsd_config

Configuration data for calculations of RMSDs between structures


Uses


Contents

Derived Types

Subroutines


Derived Types

type, public :: rmsd_config_type

Configuration data for RMSD calculations

Type-Bound Procedures

procedure, public :: get_filter

Select a filter from the configuration data

Subroutines

public subroutine new_rmsd_config(self, table, error)

Create new configuration data from TOML data structure

Arguments

TypeIntentOptionalAttributesName
type(rmsd_config_type), intent(out) :: self

Instance of the configuration data
type(toml_table), intent(inout) :: table

TOML data structure
type(error_type), intent(out), allocatable:: error

Error handling