#include <gromacs/applied_forces/densityfitting/densityfitting.h>

Description

Information about the density fitting module.

Provides name and method to create a density fitting module.

Static Public Member Functions
static std::unique_ptr< IMDModule >	create ()
	Creates a module for applying forces to fit a given density. More...

Static Public Attributes
static constexpr std::string_view	sc_name = "density-guided-simulation"
	The name of the module.

Member Function Documentation

std::unique_ptr< IMDModule > gmx::DensityFittingModuleInfo::create ( )

static

Creates a module for applying forces to fit a given density.

Fitting an all-atom structure into an experimental cryo-EM density map is a typical application.

The documentation for this struct was generated from the following files: