Optimized way to find pairwise cosine distance matrix using pairwise_distances_chunked - numpy

I have a numpy array with 42000 (rows) * 110000 (dimensions) ,I am trying to create a pairwise distance matrix(42000*42000) with 32GB ram and 8 cores.
I tried pairwise_distances_chunked but it is only giving 3120*42000 distance matrix .Also used pairwise_distances but it is giving out of memory error.
Any suggestions what can be done?

Reading the documentation for pairwise_distances_chunked, it yields a chunk at a time. Based on the way you phrased your question, it seems like you did this:
D_chunk = next(pairwise_distances_chunked(X))
That code (which is the first example from the documentation) only gives you the first chunk.
What you want to do is this:
for chunk in pairwise_distances_chunked(X):
do_something(chunk)

Related

Sampling from a point pattern

I have a 3D point distribution in a numpy array formed of 1,000,000 points, lets call it points. I would like to take a 10% uniform sample so that the points are evenly distributed (e.g. every 10th point)
I think this is what I'm looking for but this generates data, how do I sample existing data?
numpy.random.uniform(low=0.0, high=1.0, size=None)
In case I understood the problem right you would just need to do this:
points[::10]
to get every 10th element of points.
If that is not what you wanted, please clarify.
simple indexing will do it:
# data
x = numpy.random.uniform(low=0.0, high=1.0, size=(300,3))
#sampled result
sample_step = 10
y = x[:-1:sample_step]

Optimizing Python KD Tree Searches

Scipy (http://www.scipy.org/) offers two KD Tree classes; the KDTree and the cKDTree.
The cKDTree is much faster, but is less customizable and query-able than the KDTree (as far as I can tell from the docs).
Here is my problem:
I have a list of 3million 2 dimensional (X,Y) points. I need to return all of the points within a distance of X units from every point.
With the KDtree, there is an option to do just this: KDtree.query_ball_tree() It generates a list of lists of all the points within X units from every other point. HOWEVER: this list is enormous and quickly fills up my virtual memory (about 744 million items long).
Potential solution #1: Is there a way to parse this list into a text file as it is writing?
Potential solution #2: I have tried using a for loop (for every point in the list) and then finding that single point's neighbors within X units by employing: KDtree.query_ball_point(). HOWEVER: this takes forever as it needs to run the query millions of times. Is there a cKDTree equivalent of this KDTree tool?
Potential solution #3: Beats me, anyone else have any ideas?
From scipy 0.12 on, both KD Tree classes have feature parity. Quoting its announcement:
cKDTree feature-complete
Cython version of KDTree, cKDTree, is now feature-complete. Most
operations (construction, query, query_ball_point, query_pairs,
count_neighbors and sparse_distance_matrix) are between 200 and 1000
times faster in cKDTree than in KDTree. With very minor caveats,
cKDTree has exactly the same interface as KDTree, and can be used as a
drop-in replacement.
Try using KDTree.query_ball_point instead. It takes a single point, or array of points, and produces the points within a given distance of the input point(s).
You can use this function to perform batch queries. Give it, say, 100000 points at a time, and then write the results out to a file. Something like this:
BATCH_SIZE = 100000
for i in xrange(0, len(pts), BATCH_SIZE):
neighbours = tree.query_ball_point(pts[i:i+BATCH_SIZE], X)
# write neighbours to a file...

Numpy: Reduce memory footprint of dot product with random data

I have a large numpy array that I am going to take a linear projection of using randomly generated values.
>>> input_array.shape
(50, 200000)
>>> random_array = np.random.normal(size=(200000, 300))
>>> output_array = np.dot(input_array, random_array)
Unfortunately, random_array takes up a lot of memory, and my machine starts swapping. It seems to me that I don't actually need all of random_array around at once; in theory, I ought to be able to generate it lazily during the dot product calculation...but I can't figure out how.
How can I reduce the memory footprint of the calculation of output_array from input_array?
This obviously isn't the fastest solution, but have you tried:
m, inner = input_array.shape
n = 300
out = np.empty((m, n))
for i in xrange(n):
out[:, i] = np.dot(input_array, np.random.normal(size=inner))
This might be a situation where using cython could reduce your memory usage. You could generate the random numbers on the fly and accumulate the result as you go. I don't have the time to write and test the full function, but you would definitely want to use randomkit (the library that numpy uses under the hood) at the c-level.
You can take a look at some example code I wrote for another application to see how to wrap randomkit:
https://github.com/synapticarbors/pylangevin-integrator/blob/master/cIntegrator.pyx
And also check out how matrix multiplication is implemented in the following paper on cython:
http://conference.scipy.org/proceedings/SciPy2009/paper_2/full_text.pdf
Instead of having both arrays as inputs, just have input_array as one, and then in the method, generate small chunks of the random array as you go.
Sorry if it is just a sketch instead of actual code, but hopefully it is enough to get you started.

Optimize MATLAB code (nested for loop to compute similarity matrix)

I am computing a similarity matrix based on Euclidean distance in MATLAB. My code is as follows:
for i=1:N % M,N is the size of the matrix x for whose elements I am computing similarity matrix
for j=1:N
D(i,j) = sqrt(sum(x(:,i)-x(:,j)).^2)); % D is the similarity matrix
end
end
Can any help with optimizing this = reducing the for loops as my matrix x is of dimension 256x30000.
Thanks a lot!
--Aditya
The function to do so in matlab is called pdist. Unfortunately it is painfully slow and doesnt take Matlabs vectorization abilities into account.
The following is code I wrote for a project. Let me know what kind of speed up you get.
Qx=repmat(dot(x,x,2),1,size(x,1));
D=sqrt(Qx+Qx'-2*x*x');
Note though that this will only work if your data points are in the rows and your dimensions the columns. So for example lets say I have 256 data points and 100000 dimensions then on my mac using x=rand(256,100000) and the above code produces a 256x256 matrix in about half a second.
There's probably a better way to do it, but the first thing I noticed was that you could cut the runtime in half by exploiting the symmetry D(i,j)==D(i,j)
You can also use the function norm(x(:,i)-x(:,j),2)
I think this is what you're looking for.
D=zeros(N);
jIndx=repmat(1:N,N,1);iIndx=jIndx'; %'# fix SO's syntax highlighting
D(:)=sqrt(sum((x(iIndx(:),:)-x(jIndx(:),:)).^2,2));
Here, I have assumed that the distance vector, x is initalized as an NxM array, where M is the number of dimensions of the system and N is the number of points. So if your ordering is different, you'll have to make changes accordingly.
To start with, you are computing twice as much as you need to here, because D will be symmetric. You don't need to calculate the (i,j) entry and the (j,i) entry separately. Change your inner loop to for j=1:i, and add in the body of that loop D(j,i)=D(i,j);
After that, there's really not much redundancy left in what that code does, so your only room left for improvement is to parallelize it: if you have the Parallel Computing Toolbox, convert your outer loop to a parfor and before you run it, say matlabpool(n), where n is the number of threads to use.

VB FFT - stuck understanding relationship of results to frequency

Trying to understand an fft (Fast Fourier Transform) routine I'm using (stealing)(recycling)
Input is an array of 512 data points which are a sample waveform.
Test data is generated into this array. fft transforms this array into frequency domain.
Trying to understand relationship between freq, period, sample rate and position in fft array. I'll illustrate with examples:
========================================
Sample rate is 1000 samples/s.
Generate a set of samples at 10Hz.
Input array has peak values at arr(28), arr(128), arr(228) ...
period = 100 sample points
peak value in fft array is at index 6 (excluding a huge value at 0)
========================================
Sample rate is 8000 samples/s
Generate set of samples at 440Hz
Input array peak values include arr(7), arr(25), arr(43), arr(61) ...
period = 18 sample points
peak value in fft array is at index 29 (excluding a huge value at 0)
========================================
How do I relate the index of the peak in the fft array to frequency ?
If you ignore the imaginary part, the frequency distribution is linear across bins:
Frequency#i = (Sampling rate/2)*(i/Nbins).
So for your first example, assumming you had 256 bins, the largest bin corresponds to a frequency of 1000/2 * 6/256 = 11.7 Hz.
Since your input was 10Hz, I'd guess that bin 5 (9.7Hz) also had a big component.
To get better accuracy, you need to take more samples, to get smaller bins.
Your second example gives 8000/2*29/256 = 453Hz. Again, close, but you need more bins.
Your resolution here is only 4000/256 = 15.6Hz.
It would be helpful if you were to provide your sample dataset.
My guess would be that you have what are called sampling artifacts. The strong signal at DC ( frequency 0 ) suggests that this is the case.
You should always ensure that the average value in your input data is zero - find the average and subtract it from each sample point before invoking the fft is good practice.
Along the same lines, you have to be careful about the sampling window artifact. It is important that the first and last data point are close to zero because otherwise the "step" from outside to inside the sampling window has the effect of injecting a whole lot of energy at different frequencies.
The bottom line is that doing an fft analysis requires more care than simply recycling a fft routine found somewhere.
Here are the first 100 sample points of a 10Hz signal as described in the question, massaged to avoid sampling artifacts
> sinx[1:100]
[1] 0.000000e+00 6.279052e-02 1.253332e-01 1.873813e-01 2.486899e-01 3.090170e-01 3.681246e-01 4.257793e-01 4.817537e-01 5.358268e-01
[11] 5.877853e-01 6.374240e-01 6.845471e-01 7.289686e-01 7.705132e-01 8.090170e-01 8.443279e-01 8.763067e-01 9.048271e-01 9.297765e-01
[21] 9.510565e-01 9.685832e-01 9.822873e-01 9.921147e-01 9.980267e-01 1.000000e+00 9.980267e-01 9.921147e-01 9.822873e-01 9.685832e-01
[31] 9.510565e-01 9.297765e-01 9.048271e-01 8.763067e-01 8.443279e-01 8.090170e-01 7.705132e-01 7.289686e-01 6.845471e-01 6.374240e-01
[41] 5.877853e-01 5.358268e-01 4.817537e-01 4.257793e-01 3.681246e-01 3.090170e-01 2.486899e-01 1.873813e-01 1.253332e-01 6.279052e-02
[51] -2.542075e-15 -6.279052e-02 -1.253332e-01 -1.873813e-01 -2.486899e-01 -3.090170e-01 -3.681246e-01 -4.257793e-01 -4.817537e-01 -5.358268e-01
[61] -5.877853e-01 -6.374240e-01 -6.845471e-01 -7.289686e-01 -7.705132e-01 -8.090170e-01 -8.443279e-01 -8.763067e-01 -9.048271e-01 -9.297765e-01
[71] -9.510565e-01 -9.685832e-01 -9.822873e-01 -9.921147e-01 -9.980267e-01 -1.000000e+00 -9.980267e-01 -9.921147e-01 -9.822873e-01 -9.685832e-01
[81] -9.510565e-01 -9.297765e-01 -9.048271e-01 -8.763067e-01 -8.443279e-01 -8.090170e-01 -7.705132e-01 -7.289686e-01 -6.845471e-01 -6.374240e-01
[91] -5.877853e-01 -5.358268e-01 -4.817537e-01 -4.257793e-01 -3.681246e-01 -3.090170e-01 -2.486899e-01 -1.873813e-01 -1.253332e-01 -6.279052e-02
And here is the resulting absolute values of the fft frequency domain
[1] 7.160038e-13 1.008741e-01 2.080408e-01 3.291725e-01 4.753899e-01 6.653660e-01 9.352601e-01 1.368212e+00 2.211653e+00 4.691243e+00 5.001674e+02
[12] 5.293086e+00 2.742218e+00 1.891330e+00 1.462830e+00 1.203175e+00 1.028079e+00 9.014559e-01 8.052577e-01 7.294489e-01
I'm a little rusty too on math and signal processing but with the additional info I can give it a shot.
If you want to know the signal energy per bin you need the magnitude of the complex output. So just looking at the real output is not enough. Even when the input is only real numbers. For every bin the magnitude of the output is sqrt(real^2 + imag^2), just like pythagoras :-)
bins 0 to 449 are positive frequencies from 0 Hz to 500 Hz. bins 500 to 1000 are negative frequencies and should be the same as the positive for a real signal. If you process one buffer every second frequencies and array indices line up nicely. So the peak at index 6 corresponds with 6Hz so that's a bit strange. This might be because you're only looking at the real output data and the real and imaginary data combine to give an expected peak at index 10. The frequencies should map linearly to the bins.
The peaks at 0 indicates a DC offset.
It's been some time since I've done FFT's but here's what I remember
FFT usually takes complex numbers as input and output. So I'm not really sure how the real and imaginary part of the input and output map to the arrays.
I don't really understand what you're doing. In the first example you say you process sample buffers at 10Hz for a sample rate of 1000 Hz? So you should have 10 buffers per second with 100 samples each. I don't get how your input array can be at least 228 samples long.
Usually the first half of the output buffer are frequency bins from 0 frequency (=dc offset) to 1/2 sample rate. and the 2nd half are negative frequencies. if your input is only real data with 0 for the imaginary signal positive and negative frequencies are the same. The relationship of real/imaginary signal on the output contains phase information from your input signal.
The frequency for bin i is i * (samplerate / n), where n is the number of samples in the FFT's input window.
If you're handling audio, since pitch is proportional to log of frequency, the pitch resolution of the bins increases as the frequency does -- it's hard to resolve low frequency signals accurately. To do so you need to use larger FFT windows, which reduces time resolution. There is a tradeoff of frequency against time resolution for a given sample rate.
You mention a bin with a large value at 0 -- this is the bin with frequency 0, i.e. the DC component. If this is large, then presumably your values are generally positive. Bin n/2 (in your case 256) is the Nyquist frequency, half the sample rate, which is the highest frequency that can be resolved in the sampled signal at this rate.
If the signal is real, then bins n/2+1 to n-1 will contain the complex conjugates of bins n/2-1 to 1, respectively. The DC value only appears once.
The samples are, as others have said, equally spaced in the frequency domain (not logarithmic).
For example 1, you should get this:
alt text http://home.comcast.net/~kootsoop/images/SINE1.jpg
For the other example you should get
alt text http://home.comcast.net/~kootsoop/images/SINE2.jpg
So your answers both appear to be correct regarding the peak location.
What I'm not getting is the large DC component. Are you sure you are generating a sine wave as the input? Does the input go negative? For a sinewave, the DC should be close to zero provided you get enough cycles.
Another avenue is to craft a Goertzel's Algorithm of each note center frequency you are looking for.
Once you get one implementation of the algorithm working you can make it such that it takes parameters to set it's center frequency. With that you could easily run 88 of them or what ever you need in a collection and scan for the peak value.
The Goertzel Algorithm is basically a single bin FFT. Using this method you can place your bins logarithmically as musical notes naturally go.
Some pseudo code from Wikipedia:
s_prev = 0
s_prev2 = 0
coeff = 2*cos(2*PI*normalized_frequency);
for each sample, x[n],
s = x[n] + coeff*s_prev - s_prev2;
s_prev2 = s_prev;
s_prev = s;
end
power = s_prev2*s_prev2 + s_prev*s_prev - coeff*s_prev2*s_prev;
The two variables representing the previous two samples are maintained for the next iteration. This can be then used in a streaming application. I thinks perhaps the power calculation should be inside the loop as well. (However it is not depicted as such in the Wiki article.)
In the tone detection case there would be 88 different coeficients, 88 pairs of previous samples and would result in 88 power output samples indicating the relative level in that frequency bin.
WaveyDavey says that he's capturing sound from a mic, thru the audio hardware of his computer, BUT that his results are not zero-centered. This sounds like a problem with the hardware. It SHOULD BE zero-centered.
When the room is quiet, the stream of values coming from the sound API should be very close to 0 amplitude, with slight +- variations for ambient noise. If a vibratory sound is present in the room (e.g. a piano, a flute, a voice) the data stream should show a fundamentally sinusoidal-based wave that goes both positive and negative, and averages near zero. If this is not the case, the system has some funk going on!
-Rick