bmodfit.cpp File Reference

A tool to fit models. More...

#include "model_transform.h"
#include "utilities.h"
#include "options.h"
#include "timer.h"

Functions
int	model_fit (Bmodel *model, Bmodel *refmod, string id)
	Fits a model to a reference model. More...
int	main (int argc, char **argv)

Variables
int	verbose
const char *	use []

Detailed Description

A tool to fit models.

Author

Bernard Heymann

Date

Created: 20220223

Modified: 20220223

Function Documentation

main()

int main	(	int	argc,
		char **	argv
	)

model_fit()

int model_fit	(	Bmodel *	model,
		Bmodel *	refmod,
		string	id
	)

Fits a model to a reference model.

Parameters

model	model structure.
refmod	reference model.
id	model id to fit.

Returns

int 0.

Variable Documentation

use

const char* use[]

Initial value:

= {
" ",
"Usage: bmodfit [options] in.star",
"--------------------------------",
"Calculate fits of model to a reference.",
" ",
"Actions:",
"-fit mod_id              Fit a model with the given id to a reference.",
" ",
"Parameters:",
"-verbose 7               Verbosity of output.",
" ",
"Input:",
"-reference ref.pdb       Input reference model file.",
" ",
"Output:",
"-output newmod.star      Output model file.",
" ",
NULL
}

verbose

int verbose

extern