mod test;
use rand::prelude::*;
use rand_distr::{Normal, Distribution};
use std::f64::consts::TAU as TWO_PI;
pub fn random_configuration<const NUMBER_OF_LINKS: usize>(dist: Normal<f64>, rng: &mut ThreadRng) -> [[f64; 3]; NUMBER_OF_LINKS]
{
let mut lambda: f64 = 0.0;
let mut phi: f64 = 0.0;
let mut theta: f64 = 0.0;
let mut position = [0.0; 3];
let mut configuration = [[0.0; 3]; NUMBER_OF_LINKS];
configuration.iter_mut().for_each(|coordinate|{
lambda = dist.sample(rng);
phi = TWO_PI * rng.gen::<f64>();
theta = (1.0 - 2.0 * rng.gen::<f64>()).acos();
position[0] += lambda * (theta.sin() * phi.cos());
position[1] += lambda * (theta.sin() * phi.sin());
position[2] += lambda * theta.cos();
coordinate.iter_mut().zip(position.iter()).for_each(|(coordinate_i, position_i)|
*coordinate_i = *position_i
);
});
configuration
}
pub fn random_nondimensional_end_to_end_length<const NUMBER_OF_LINKS: usize>(dist: Normal<f64>, rng: &mut ThreadRng) -> f64
{
random_configuration::<NUMBER_OF_LINKS>(dist, rng)[NUMBER_OF_LINKS - 1].iter().map(|entry| entry * entry).sum::<f64>().sqrt()
}
pub fn nondimensional_equilibrium_radial_distribution<const NUMBER_OF_BINS: usize, const NUMBER_OF_LINKS: usize>(gamma_max: &f64, kappa: &f64, number_of_samples: usize) -> ([f64; NUMBER_OF_BINS], [f64; NUMBER_OF_BINS])
{
let mut rng = rand::thread_rng();
let dist = Normal::new(1.0, 1.0/kappa.sqrt()).unwrap();
let number_of_links_f64 = NUMBER_OF_LINKS as f64;
let mut bin_edges = [0.0_f64; NUMBER_OF_BINS];
bin_edges.iter_mut().enumerate().for_each(|(bin_index, bin_edge)|
*bin_edge = gamma_max * (bin_index as f64 + 1.0)/(NUMBER_OF_BINS as f64)
);
let mut bin_counts = [0_u128; NUMBER_OF_BINS];
let mut gamma: f64 = 0.0;
(0..number_of_samples).for_each(|_|{
gamma = random_nondimensional_end_to_end_length::<NUMBER_OF_LINKS>(dist, &mut rng)/number_of_links_f64;
for (bin_edge, bin_count) in bin_edges.iter().zip(bin_counts.iter_mut())
{
if &gamma > gamma_max
{
panic!()
}
if &gamma < bin_edge
{
*bin_count += 1;
break
}
}
});
let normalization = gamma_max * (number_of_samples as f64)/(NUMBER_OF_BINS as f64);
let mut bin_probabilities = [0.0_f64; NUMBER_OF_BINS];
bin_probabilities.iter_mut().zip(bin_counts.iter()).for_each(|(bin_probability, bin_count)|
*bin_probability = (*bin_count as f64)/normalization
);
let mut bin_centers = [0.0_f64; NUMBER_OF_BINS];
bin_centers.iter_mut().enumerate().for_each(|(bin_index, bin_center)|
*bin_center = gamma_max * (bin_index as f64 + 0.5)/(NUMBER_OF_BINS as f64)
);
(bin_centers, bin_probabilities)
}