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phelix
rust
OPOSSUM
Commits
68582259
Commit
68582259
authored
1 year ago
by
Udo Eisenbarth
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Work on resampling fn
parent
65916fd0
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1 changed file
src/spectrum.rs
+83
-18
83 additions, 18 deletions
src/spectrum.rs
with
83 additions
and
18 deletions
src/spectrum.rs
+
83
−
18
View file @
68582259
use
crate
::
error
::
OpossumError
;
use
ndarray
::
Array1
;
use
ndarray_interp
::
Interp1DBuilder
;
use
ndarray_interp
::
Interp1DStrategy
::
Linear
;
use
std
::
fmt
::
Display
;
use
std
::
ops
::
Range
;
use
uom
::
fmt
::
DisplayStyle
::
Abbreviation
;
...
...
@@ -9,8 +11,8 @@ use uom::si::{f64::Length, length::nanometer};
type
Result
<
T
>
=
std
::
result
::
Result
<
T
,
OpossumError
>
;
pub
struct
Spectrum
{
data
:
Array1
<
f64
>
,
lambdas
:
Array1
<
f64
>
,
data
:
Array1
<
f64
>
,
// data in 1/meters
lambdas
:
Array1
<
f64
>
,
// wavelength in meters
}
impl
Spectrum
{
...
...
@@ -57,13 +59,15 @@ impl Spectrum {
.position
(|
w
|
w
>=
wavelength_in_meters
);
if
let
Some
(
idx
)
=
idx
{
if
idx
==
0
{
self
.data
[
0
]
=
value
;
let
delta
=
self
.lambdas
.get
(
1
)
.unwrap
()
-
self
.lambdas
.get
(
0
)
.unwrap
();
self
.data
[
0
]
=
value
/
delta
;
}
else
{
let
lower_lambda
=
self
.lambdas
.get
(
idx
-
1
)
.unwrap
();
let
upper_lambda
=
self
.lambdas
.get
(
idx
)
.unwrap
();
let
delta
=
upper_lambda
-
lower_lambda
;
self
.data
[
idx
-
1
]
=
value
*
(
1.0
-
(
wavelength_in_meters
-
lower_lambda
)
/
delta
);
self
.data
[
idx
]
=
value
*
(
wavelength_in_meters
-
lower_lambda
)
/
delta
;
self
.data
[
idx
-
1
]
=
value
*
(
1.0
-
(
wavelength_in_meters
-
lower_lambda
)
/
delta
)
/
delta
;
self
.data
[
idx
]
=
value
*
(
wavelength_in_meters
-
lower_lambda
)
/
delta
/
delta
;
}
Ok
(())
}
else
{
...
...
@@ -72,8 +76,12 @@ impl Spectrum {
}
pub
fn
total_energy
(
&
self
)
->
f64
{
let
mut
total_energy
=
0.0
;
for
data
in
self
.data
.iter
()
{
total_energy
+=
*
data
;
for
data
in
self
.data
.iter
()
.enumerate
()
{
if
data
.0
<
self
.data
.len
()
-
1
{
let
delta
=
self
.lambdas
.get
(
data
.0
+
1
)
.unwrap
()
-
self
.lambdas
.get
(
data
.0
)
.unwrap
();
total_energy
+=
*
data
.1
*
delta
;
}
}
total_energy
}
...
...
@@ -87,9 +95,33 @@ impl Spectrum {
Ok
(())
}
pub
fn
resample
(
&
mut
self
,
spectrum
:
&
Spectrum
)
->
Result
<
()
>
{
let
data
=
spectrum
.data
.clone
();
let
x
=
spectrum
.lambdas
.clone
();
let
interpolator
=
Interp1DBuilder
::
new
(
data
)
.x
(
x
)
.strategy
(
Linear
{
extrapolate
:
false
})
.build
()
.unwrap
();
let
max_idx
=
self
.data
.len
();
let
integration_step_size
=
0.05
;
for
x
in
self
.data
.iter_mut
()
.enumerate
()
{
if
x
.0
<
max_idx
-
1
{
let
lower_bound
=
*
self
.lambdas
.get
(
x
.0
)
.unwrap
();
let
upper_bound
=
*
self
.lambdas
.get
(
x
.0
+
1
)
.unwrap
();
let
integration_x
=
Array1
::
range
(
lower_bound
,
upper_bound
,
integration_step_size
);
println!
(
"integrate at: {}"
,
integration_x
);
let
mut
integration_sum
=
0.0
;
for
i_x
in
integration_x
.iter
()
{
integration_sum
+=
interpolator
.interp_scalar
(
*
i_x
)
.unwrap
();
}
*
x
.1
=
integration_sum
*
integration_step_size
;
println!
(
"sum={}"
,
*
x
.1
);
}
}
//self.data = interpolator.interp_array(&query).unwrap();
Ok
(())
}
pub
fn
filter
(
&
mut
self
,
spectrum
:
&
Spectrum
)
->
Result
<
()
>
{
pub
fn
filter
(
&
mut
self
,
_
spectrum
:
&
Spectrum
)
->
Result
<
()
>
{
Ok
(())
}
}
...
...
@@ -155,41 +187,41 @@ mod test {
fn
set_single_peak
()
{
let
mut
s
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.0
)
..
Length
::
new
::
<
meter
>
(
4.0
),
Length
::
new
::
<
meter
>
(
1.0
),
Length
::
new
::
<
meter
>
(
0.5
),
)
.unwrap
();
assert_eq!
(
s
.set_single_peak
(
Length
::
new
::
<
meter
>
(
2.0
),
1.0
)
.is_ok
(),
true
);
assert_eq!
(
s
.data
[
1
],
1
.0
);
assert_eq!
(
s
.data
[
2
],
2
.0
);
}
#[test]
fn
set_single_peak_interpolated
()
{
let
mut
s
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.0
)
..
Length
::
new
::
<
meter
>
(
4.0
),
Length
::
new
::
<
meter
>
(
1.0
),
Length
::
new
::
<
meter
>
(
0.5
),
)
.unwrap
();
assert_eq!
(
s
.set_single_peak
(
Length
::
new
::
<
meter
>
(
2.5
),
1.0
)
.is_ok
(),
s
.set_single_peak
(
Length
::
new
::
<
meter
>
(
2.
2
5
),
1.0
)
.is_ok
(),
true
);
assert_eq!
(
s
.data
[
1
],
0.5
);
assert_eq!
(
s
.data
[
2
],
0.5
);
assert_eq!
(
s
.data
[
2
],
1.0
);
assert_eq!
(
s
.data
[
3
],
1.0
);
}
#[test]
fn
set_single_peak_lower_bound
()
{
let
mut
s
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.0
)
..
Length
::
new
::
<
meter
>
(
4.0
),
Length
::
new
::
<
meter
>
(
1.0
),
Length
::
new
::
<
meter
>
(
0.5
),
)
.unwrap
();
assert_eq!
(
s
.set_single_peak
(
Length
::
new
::
<
meter
>
(
1.0
),
1.0
)
.is_ok
(),
true
);
assert_eq!
(
s
.data
[
0
],
1
.0
);
assert_eq!
(
s
.data
[
0
],
2
.0
);
}
#[test]
fn
set_single_peak_out_of_limit
()
{
...
...
@@ -208,7 +240,7 @@ mod test {
);
}
#[test]
fn
set_single_peak_ngative_energy
()
{
fn
set_single_peak_n
e
gative_energy
()
{
let
mut
s
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.0
)
..
Length
::
new
::
<
meter
>
(
4.0
),
Length
::
new
::
<
meter
>
(
1.0
),
...
...
@@ -223,7 +255,7 @@ mod test {
fn
total_energy
()
{
let
mut
s
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.0
)
..
Length
::
new
::
<
meter
>
(
4.0
),
Length
::
new
::
<
meter
>
(
1.0
),
Length
::
new
::
<
meter
>
(
0.5
),
)
.unwrap
();
s
.set_single_peak
(
Length
::
new
::
<
meter
>
(
2.0
),
1.0
)
.unwrap
();
...
...
@@ -250,4 +282,37 @@ mod test {
s
.set_single_peak
(
Length
::
new
::
<
meter
>
(
2.5
),
1.0
)
.unwrap
();
assert_eq!
(
s
.scale_vertical
(
-
0.5
)
.is_ok
(),
false
);
}
// #[test]
// fn resample() {
// let mut s1 = Spectrum::new(
// Length::new::<meter>(1.0)..Length::new::<meter>(5.0),
// Length::new::<meter>(1.0),
// )
// .unwrap();
// s1.set_single_peak(Length::new::<meter>(2.0), 1.0).unwrap();
// let s2 = Spectrum::new(
// Length::new::<meter>(1.0)..Length::new::<meter>(5.0),
// Length::new::<meter>(1.0),
// )
// .unwrap();
// s1.resample(&s2).unwrap();
// assert_eq!(s1.data, s2.data);
// }
#[test]
fn
resample_interp
()
{
let
mut
s1
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.5
)
..
Length
::
new
::
<
meter
>
(
5.0
),
Length
::
new
::
<
meter
>
(
1.0
),
)
.unwrap
();
let
mut
s2
=
Spectrum
::
new
(
Length
::
new
::
<
meter
>
(
1.0
)
..
Length
::
new
::
<
meter
>
(
6.0
),
Length
::
new
::
<
meter
>
(
0.5
),
)
.unwrap
();
s2
.set_single_peak
(
Length
::
new
::
<
meter
>
(
2.5
),
1.0
)
.unwrap
();
println!
(
"s2: {}"
,
s2
);
s1
.resample
(
&
s2
)
.unwrap
();
assert_eq!
(
s1
.data
,
array!
[
0.0
,
0.5
,
0.5
,
0.0
]);
}
}
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