speeding up processing 5 million rows of coordinate data - python

I have a csv file with two columns (latitude, longitude) that contains over 5 million rows of geolocation data.
I need to identify the points which are not within 5 miles of any other point in the list, and output everything back into another CSV that has an extra column (CloseToAnotherPoint) which is True if there is another point is within 5 miles, and False if there isn't.
Here is my current solution using geopy (not making any web calls, just using the function to calculate distance):
from geopy.point import Point
from geopy.distance import vincenty
import csv
class CustomGeoPoint(object):
def __init__(self, latitude, longitude):
self.location = Point(latitude, longitude)
self.close_to_another_point = False
try:
output = open('output.csv','w')
writer = csv.writer(output, delimiter = ',', quoting=csv.QUOTE_ALL)
writer.writerow(['Latitude', 'Longitude', 'CloseToAnotherPoint'])
# 5 miles
close_limit = 5
geo_points = []
with open('geo_input.csv', newline='') as geo_csv:
reader = csv.reader(geo_csv)
next(reader, None) # skip the headers
for row in reader:
geo_points.append(CustomGeoPoint(row[0], row[1]))
# for every point, look at every point until one is found within 5 miles
for geo_point in geo_points:
for geo_point2 in geo_points:
dist = vincenty(geo_point.location, geo_point2.location).miles
if 0 < dist <= close_limit: # (0,close_limit]
geo_point.close_to_another_point = True
break
writer.writerow([geo_point.location.latitude, geo_point.location.longitude,
geo_point.close_to_another_point])
finally:
output.close()
As you might be able to tell from looking at it, this solution is extremely slow. So slow in fact that I let it run for 3 days and it still didn't finish!
I've thought about trying to split up the data into chunks (multiple CSV files or something) so that the inner loop doesn't have to look at every other point, but then I would have to figure out how to make sure the borders of each section checked against the borders of its adjacent sections, and that just seems overly complex and I'm afraid it would be more of a headache than it's worth.
So any pointers on how to make this faster?

Let's look at what you're doing.
You read all the points into a list named geo_points.
Now, can you tell me whether the list is sorted? Because if it was sorted, we definitely want to know that. Sorting is valuable information, especially when you're dealing with 5 million of anything.
You loop over all the geo_points. That's 5 million, according to you.
Within the outer loop, you loop again over all 5 million geo_points.
You compute the distance in miles between the two loop items.
If the distance is less than your threshold, you record that information on the first point, and stop the inner loop.
When the inner loop stops, you write information about the outer loop item to a CSV file.
Notice a couple of things. First, you're looping 5 million times in the outer loop. And then you're looping 5 million times in the inner loop.
This is what O(n²) means.
The next time you see someone talking about "Oh, this is O(log n) but that other thing is O(n log n)," remember this experience - you're running an n² algorithm where n in this case is 5,000,000. Sucks, dunnit?
Anyway, you have some problems.
Problem 1: You'll eventually wind up comparing every point against itself. Which should have a distance of zero, meaning they will all be marked as within whatever distance threshold. If your program ever finishes, all the cells will be marked True.
Problem 2: When you compare point #1 with, say, point #12345, and they are within the threshold distance from each other, you are recording that information about point #1. But you don't record the same information about the other point. You know that point #12345 (geo_point2) is reflexively within the threshold of point #1, but you don't write that down. So you're missing a chance to just skip over 5 million comparisons.
Problem 3: If you compare point #1 and point #2, and they are not within the threshold distance, what happens when you compare point #2 with point #1? Your inner loop is starting from the beginning of the list every time, but you know that you have already compared the start of the list with the end of the list. You can reduce your problem space by half just by making your outer loop go i in range(0, 5million) and your inner loop go j in range(i+1, 5million).
Answers?
Consider your latitude and longitude on a flat plane. You want to know if there's a point within 5 miles. Let's think about a 10 mile square, centered on your point #1. That's a square centered on (X1, Y1), with a top left corner at (X1 - 5miles, Y1 + 5miles) and a bottom right corner at (X1 + 5miles, Y1 - 5miles). Now, if a point is within that square, it might not be within 5 miles of your point #1. But you can bet that if it's outside that square, it's more than 5 miles away.
As #SeverinPappadeaux points out, distance on a spheroid like Earth is not quite the same as distance on a flat plane. But so what? Set your square a little bigger to allow for the difference, and proceed!
Sorted List
This is why sorting is important. If all the points were sorted by X, then Y (or Y, then X - whatever) and you knew it, you could really speed things up. Because you could simply stop scanning when the X (or Y) coordinate got too big, and you wouldn't have to go through 5 million points.
How would that work? Same way as before, except your inner loop would have some checks like this:
five_miles = ... # Whatever math, plus an error allowance!
list_len = len(geo_points) # Don't call this 5 million times
for i, pi in enumerate(geo_points):
if pi.close_to_another_point:
continue # Remember if close to an earlier point
pi0max = pi[0] + five_miles
pi1min = pi[1] - five_miles
pi1max = pi[1] + five_miles
for j in range(i+1, list_len):
pj = geo_points[j]
# Assumes geo_points is sorted on [0] then [1]
if pj[0] > pi0max:
# Can't possibly be close enough, nor any later points
break
if pj[1] < pi1min or pj[1] > pi1max:
# Can't be close enough, but a later point might be
continue
# Now do "real" comparison using accurate functions.
if ...:
pi.close_to_another_point = True
pj.close_to_another_point = True
break
What am I doing there? First, I'm getting some numbers into local variables. Then I'm using enumerate to give me an i value and a reference to the outer point. (What you called geo_point). Then, I'm quickly checking to see if we already know that this point is close to another one.
If not, we'll have to scan. So I'm only scanning "later" points in the list, because I know the outer loop scans the early ones, and I definitely don't want to compare a point against itself. I'm using a few temporary variables to cache the result of computations involving the outer loop. Within the inner loop, I do some stupid comparisons against the temporaries. They can't tell me if the two points are close to each other, but I can check if they're definitely not close and skip ahead.
Finally, if the simple checks pass then go ahead and do the expensive checks. If a check actually passes, be sure to record the result on both points, so we can skip doing the second point later.
Unsorted List
But what if the list is not sorted?
#RootTwo points you at a kD tree (where D is for "dimensional" and k in this case is "2"). The idea is really simple, if you already know about binary search trees: you cycle through the dimensions, comparing X at even levels in the tree and comparing Y at odd levels (or vice versa). The idea would be this:
def insert_node(node, treenode, depth=0):
dimension = depth % 2 # even/odd -> lat/long
dn = node.coord[dimension]
dt = treenode.coord[dimension]
if dn < dt:
# go left
if treenode.left is None:
treenode.left = node
else:
insert_node(node, treenode.left, depth+1)
else:
# go right
if treenode.right is None:
treenode.right = node
else:
insert_node(node, treenode.right, depth+1)
What would this do? This would get you a searchable tree where points could be inserted in O(log n) time. That means O(n log n) for the whole list, which is way better than n squared! (The log base 2 of 5 million is basically 23. So n log n is 5 million times 23, compared with 5 million times 5 million!)
It also means you can do a targeted search. Since the tree is ordered, it's fairly straightforward to look for "close" points (the Wikipedia link from #RootTwo provides an algorithm).
Advice
My advice is to just write code to sort the list, if needed. It's easier to write, and easier to check by hand, and it's a separate pass you will only need to make one time.
Once you have the list sorted, try the approach I showed above. It's close to what you were doing, and it should be easy for you to understand and code.

As the answer to Python calculate lots of distances quickly points out, this is a classic use case for k-D trees.
An alternative is to use a sweep line algorithm, as shown in the answer to How do I match similar coordinates using Python?
Here's the sweep line algorithm adapted for your questions. On my laptop, it takes < 5 minutes to run through 5M random points.
import itertools as it
import operator as op
import sortedcontainers # handy library on Pypi
import time
from collections import namedtuple
from math import cos, degrees, pi, radians, sqrt
from random import sample, uniform
Point = namedtuple("Point", "lat long has_close_neighbor")
miles_per_degree = 69
number_of_points = 5000000
data = [Point(uniform( -88.0, 88.0), # lat
uniform(-180.0, 180.0), # long
True
)
for _ in range(number_of_points)
]
start = time.time()
# Note: lat is first in Point, so data is sorted by .lat then .long.
data.sort()
print(time.time() - start)
# Parameter that determines the size of a sliding lattitude window
# and therefore how close two points need to be to be to get flagged.
threshold = 5.0 # miles
lat_span = threshold / miles_per_degree
coarse_threshold = (.98 * threshold)**2
# Sliding lattitude window. Within the window, observations are
# ordered by longitude.
window = sortedcontainers.SortedListWithKey(key=op.attrgetter('long'))
# lag_pt is the 'southernmost' point within the sliding window.
point = iter(data)
lag_pt = next(point)
milepost = len(data)//10
# lead_pt is the 'northernmost' point in the sliding window.
for i, lead_pt in enumerate(data):
if i == milepost:
print('.', end=' ')
milepost += len(data)//10
# Dec of lead_obs represents the leading edge of window.
window.add(lead_pt)
# Remove observations further than the trailing edge of window.
while lead_pt.lat - lag_pt.lat > lat_span:
window.discard(lag_pt)
lag_pt = next(point)
# Calculate 'east-west' width of window_size at dec of lead_obs
long_span = lat_span / cos(radians(lead_pt.lat))
east_long = lead_pt.long + long_span
west_long = lead_pt.long - long_span
# Check all observations in the sliding window within
# long_span of lead_pt.
for other_pt in window.irange_key(west_long, east_long):
if other_pt != lead_pt:
# lead_pt is at the top center of a box 2 * long_span wide by
# 1 * long_span tall. other_pt is is in that box. If desired,
# put additional fine-grained 'closeness' tests here.
# coarse check if any pts within 80% of threshold distance
# then don't need to check distance to any more neighbors
average_lat = (other_pt.lat + lead_pt.lat) / 2
delta_lat = other_pt.lat - lead_pt.lat
delta_long = (other_pt.long - lead_pt.long)/cos(radians(average_lat))
if delta_lat**2 + delta_long**2 <= coarse_threshold:
break
# put vincenty test here
#if 0 < vincenty(lead_pt, other_pt).miles <= close_limit:
# break
else:
data[i] = data[i]._replace(has_close_neighbor=False)
print()
print(time.time() - start)

If you sort the list by latitude (n log(n)), and the points are roughly evenly distributed, it will bring it down to about 1000 points within 5 miles for each point (napkin math, not exact). By only looking at the points that are near in latitude, the runtime goes from n^2 to n*log(n)+.0004n^2. Hopefully this speeds it up enough.

I would give pandas a try. Pandas is made for efficient handling of large amounts of data. That may help with the efficiency of the csv portion anyhow. But from the sounds of it, you've got yourself an inherently inefficient problem to solve. You take point 1 and compare it against 4,999,999 other points. Then you take point 2 and compare it with 4,999,998 other points and so on. Do the math. That's 12.5 trillion comparisons you're doing. If you can do 1,000,000 comparisons per second, that's 144 days of computation. If you can do 10,000,000 comparisons per second, that's 14 days. For just additions in straight python, 10,000,000 operations can take something like 1.1 seconds, but I doubt your comparisons are as fast as an add operation. So give it at least a fortnight or two.
Alternately, you could come up with an alternate algorithm, though I don't have any particular one in mind.

I would redo algorithm in three steps:
Use great-circle distance, and assume 1% error so make limit equal to 1.01*limit.
Code great-circle distance as inlined function, this test should be fast
You'll get some false positives, which you could further test with vincenty

A better solution generated from Oscar Smith. You have a csv file and just sorted it in excel it is very efficient). Then utilize binary search in your program to find the cities within 5 miles(you can make small change to binary search method so it will break if it finds one city satisfying your condition).
Another improvement is to set a map to remember the pair of cities when you find one city is within another one. For example, when you find city A is within 5 miles of city B, use Map to store the pair (B is the key and A is the value). So next time you meet B, search it in the Map first, if it has a corresponding value, you do not need to check it again. But it may use more memory so care about it. Hope it helps you.

This is just a first pass, but I've sped it up by half so far by using great_circle() instead of vincinty(), and cleaning up a couple of other things. The difference is explained here, and the loss in accuracy is about 0.17%:
from geopy.point import Point
from geopy.distance import great_circle
import csv
class CustomGeoPoint(Point):
def __init__(self, latitude, longitude):
super(CustomGeoPoint, self).__init__(latitude, longitude)
self.close_to_another_point = False
def isCloseToAnother(pointA, points):
for pointB in points:
dist = great_circle(pointA, pointB).miles
if 0 < dist <= CLOSE_LIMIT: # (0, close_limit]
return True
return False
with open('geo_input.csv', 'r') as geo_csv:
reader = csv.reader(geo_csv)
next(reader, None) # skip the headers
geo_points = sorted(map(lambda x: CustomGeoPoint(x[0], x[1]), reader))
with open('output.csv', 'w') as output:
writer = csv.writer(output, delimiter=',', quoting=csv.QUOTE_ALL)
writer.writerow(['Latitude', 'Longitude', 'CloseToAnotherPoint'])
# for every point, look at every point until one is found within a mile
for point in geo_points:
point.close_to_another_point = isCloseToAnother(point, geo_points)
writer.writerow([point.latitude, point.longitude,
point.close_to_another_point])
I'm going to improve this further.
Before:
$ time python geo.py
real 0m5.765s
user 0m5.675s
sys 0m0.048s
After:
$ time python geo.py
real 0m2.816s
user 0m2.716s
sys 0m0.041s

This problem can be solved with a VP tree. These allows querying data
with distances that are a metric obeying the triangle inequality.
The big advantage of VP trees over a k-D tree is that they can be blindly
applied to geographic data anywhere in the world without having to worry
about projecting it to a suitable 2D space. In addition a true geodesic
distance can be used (no need to worry about the differences between
geodesic distances and distances in the projection).
Here's my test: generate 5 million points randomly and uniformly on the
world. Put these into a VP tree.
Looping over all the points, query the VP tree to find any neighbor a
distance in (0km, 10km] away. (0km is not include in this set to avoid
the query point being found.) Count the number of points with no such
neighbor (which is 229573 in my case).
Cost of setting up the VP tree = 5000000 * 20 distance calculations.
Cost of the queries = 5000000 * 23 distance calculations.
Time for setup and queries is 5m 7s.
I am using C++ with GeographicLib for calculating distances, but
the algorithm can of course be implemented in any language and here's
the python version of GeographicLib.
ADDENDUM: The C++ code implementing this approach is given here.

Related

Need Help Trying to Simplify this algorithm to map points on an arbitrarily large 2d plane to unique integers

So like the title says I need help trying to map points from a 2d plane to a number line in such a way that each point is associated with a unique positive integer. Put another way, I need a function f:ZxZ->Z+ and I need f to be injective. Additionally I need to to run in a reasonable time.
So the way I've though about doing this is to basically just count points, starting at (1,1) and spiraling outwards.
Below I've written some python code to do this for some point (i,j)
def plot_to_int(i,j):
a=max(i,j) #we want to find which "square" we are in
b=(a-1)^2 #we can start the count from the last square
J=abs(j)
I=abs(i)
if i>0 and j>0: #the first quadrant
#we start counting anticlockwise
if I>J:
b+=J
#we start from the edge and count up along j
else:
b+=J+(J-i)
#when we turn the corner, we add to the count, increasing as i decreases
elif i<0 and j>0: #the second quadrant
b+=2a-1 #the total count from the first quadrant
if J>I:
b+=I
else:
b+=I+(I-J)
elif i<0 and j<0: #the third quadrant
b+=(2a-1)2 #the count from the first two quadrants
if I>J:
b+=J
else:
b+=J+(J-I)
else:
b+=(2a-1)3
if J>I:
b+=I
else:
b+=I+(I-J)
return b
I'm pretty sure this works, but as you can see it quite a bulky function. I'm trying to think of some way to simplify this "spiral counting" logic. Or possibly if there's another counting method that is simpler to code that would work too.
Here's a half-baked idea:
For every point, calculate f = x + (y-y_min)/(y_max-y_min)
Find the smallest delta d between any given f_n and f_{n+1}. Multiply all the f values by 1/d so that all f values are at least 1 apart.
Take the floor() of all the f values.
This is sort of like a projection onto the x-axis, but it tries to spread out the values so that it preserves uniqueness.
UPDATE:
If you don't know all the data and will need to feed in new data in the future, maybe there's a way to hardcode an arbitrarily large or small constant for y_max and y_min in step 1, and an arbitrary delta d for step 2 according the boundaries of the data values you expect. Or a way to calculate values for these according to the limits of the floating point arithmetic.

How to check if a GPS coordinate is close to thousands of others efficiently?

I have 11 millions of GPS coordinates to analyse, the efficiency is my major problem. The problem is the following:
I want to keep only 1 GPS coordinates (call it a node) per 50 meters radius around it. So the code is pretty simple, I have a set G and for every node in G I check if the one I want to add is too close to any other one. If it's too close (<50 meters) I don't add it. Otherwise I do add it.
The problem is that the set G is growing pretty fast and at the end to check if I want to add one node to the set I need to run a for loop over millions of elements...
Here is a simplified code for the Node class:
from geopy import distance
class Node: #a point on the map
def __init__(self, lat, long): #lat and long in degree
self.lat = lat
self.long = long
def distanceTo(self, otherNode):
return distance.distance((self.lat, self.long), (otherNode.lat, otherNode.long)).km
def equivalent(self, otherNode):
return self.distanceTo(otherNode) < 0.05 #50 meters away
Here is the 'add' process:
currentNode = Node(lat, long)
alreadyIn = False
for n in graph:
if n.equivalent(currentNode):
alreadyIn = True
break
#set of Nodes
if alreadyIn == False:
G.add(currentNode)
This is not a problem of node clustering because I am not trying to detect any pattern in the dataset. I am just trying to group nodes inside a 50 meter radius.
I think the best would be to have a data structure that given coordinates return True or False if a similar node is in the set. However I can't figure out which one to use since I don't divide the environment in squares but in circles. (Yes a Node A can be equivalent to B and C without B and C being equivalent but I don't really mind...).
Thank you for your help !
Using an object oriented approach is usually slower for calculations like this (though more readable).
You could transform your latitude,longitude to cartesian x,y,z and create numpy arrays from your nodes and use scipy's very fast cKDTree. It provides several methods for operations like this, in your case query_ball_point might be the correct one.

Speeding up distance between all possible pairs in an array

I have an array of x,y,z coordinates of several (~10^10) points (only 5 shown here)
a= [[ 34.45 14.13 2.17]
[ 32.38 24.43 23.12]
[ 33.19 3.28 39.02]
[ 36.34 27.17 31.61]
[ 37.81 29.17 29.94]]
I want to make a new array with only those points which are at least some distance d away from all other points in the list. I wrote a code using while loop,
import numpy as np
from scipy.spatial import distance
d=0.1 #or some distance
i=0
selected_points=[]
while i < len(a):
interdist=[]
j=i+1
while j<len(a):
interdist.append(distance.euclidean(a[i],a[j]))
j+=1
if all(dis >= d for dis in interdist):
np.array(selected_points.append(a[i]))
i+=1
This works, but it is taking really long to perform this calculation. I read somewhere that while loops are very slow.
I was wondering if anyone has any suggestions on how to speed up this calculation.
EDIT: While my objective of finding the particles which are at least some distance away from all the others stays the same, I just realized that there is a serious flaw in my code, let's say I have 3 particles, my code does the following, for the first iteration of i, it calculates the distances 1->2, 1->3, let's say 1->2 is less than the threshold distance d, so the code throws away particle 1. For the next iteration of i, it only does 2->3, and let's say it finds that it is greater than d, so it keeps particle 2, but this is wrong! since 2 should also be discarded with particle 1. The solution by #svohara is the correct one!
For big data sets and low-dimensional points (such as your 3-dimensional data), sometimes there is a big benefit to using a spatial indexing method. One popular choice for low-dimensional data is the k-d tree.
The strategy is to index the data set. Then query the index using the same data set, to return the 2-nearest neighbors for each point. The first nearest neighbor is always the point itself (with dist=0), so we really want to know how far away the next closest point is (2nd nearest neighbor). For those points where the 2-NN is > threshold, you have the result.
from scipy.spatial import cKDTree as KDTree
import numpy as np
#a is the big data as numpy array N rows by 3 cols
a = np.random.randn(10**8, 3).astype('float32')
# This will create the index, prepare to wait...
# NOTE: took 7 minutes on my mac laptop with 10^8 rand 3-d numbers
# there are some parameters that could be tweaked for faster indexing,
# and there are implementations (not in scipy) that can construct
# the kd-tree using parallel computing strategies (GPUs, e.g.)
k = KDTree(a)
#ask for the 2-nearest neighbors by querying the index with the
# same points
(dists, idxs) = k.query(a, 2)
# (dists, idxs) = k.query(a, 2, n_jobs=4) # to use more CPUs on query...
#Note: 9 minutes for query on my laptop, 2 minutes with n_jobs=6
# So less than 10 minutes total for 10^8 points.
# If the second NN is > thresh distance, then there is no other point
# in the data set closer.
thresh_d = 0.1 #some threshold, equiv to 'd' in O.P.'s code
d_slice = dists[:, 1] #distances to second NN for each point
res = np.flatnonzero( d_slice >= thresh_d )
Here's a vectorized approach using distance.pdist -
# Store number of pts (number of rows in a)
m = a.shape[0]
# Get the first of pairwise indices formed with the pairs of rows from a
# Simpler version, but a bit slow : idx1,_ = np.triu_indices(m,1)
shifts_arr = np.zeros(m*(m-1)/2,dtype=int)
shifts_arr[np.arange(m-1,1,-1).cumsum()] = 1
idx1 = shifts_arr.cumsum()
# Get the IDs of pairs of rows that are more than "d" apart and thus select
# the rest of the rows using a boolean mask created with np.in1d for the
# entire range of number of rows in a. Index into a to get the selected points.
selected_pts = a[~np.in1d(np.arange(m),idx1[distance.pdist(a) < d])]
For a huge dataset like 10e10, we might have to perform the operations in chunks based on the system memory available.
your algorithm is quadratic (10^20 operations), Here is a linear approach if distribution is nearly random.
Splits your space in boxes of size d/sqrt(3)^3. Put each points in its box.
Then for each box,
if there is just one point, you just have to calculate distance with points in a little neighborhood.
else there is nothing to do.
Drop the append, it must be really slow. You can have a static vector of distances and use [] to put the number in the right position.
Use min instead of all. You only need to check if the minimum distance is bigger than x.
Actually, you can break on your append in the moment that you find a distance smaller than your limit, and then you can drop out both points. In this way you even do not have to save any distance (unless you need them later).
Since d(a,b)=d(b,a) you can do the internal loop only for the following points, forget about the distances you already calculated. If you need them you can pick the faster from the array.
From your comment, I believe this would do, if you have no repeated points.
selected_points = []
for p1 in a:
save_point = True
for p2 in a:
if p1!=p2 and distance.euclidean(p1,p2)<d:
save_point = False
break
if save_point:
selected_points.append(p1)
return selected_points
In the end I check a,b and b,a because you should not modify a list while processing it, but you can be smarter using some aditional variables.

Getting Keys Within Range/Finding Nearest Neighbor From Dictionary Keys Stored As Tuples

I have a dictionary which has coordinates as keys. They are by default in 3 dimensions, like dictionary[(x,y,z)]=values, but may be in any dimension, so the code can't be hard coded for 3.
I need to find if there are other values within a certain radius of a new coordinate, and I ideally need to do it without having to import any plugins such as numpy.
My initial thought was to split the input into a cube and check no points match, but obviously that is limited to integer coordinates, and would grow exponentially slower (radius of 5 would require 729x the processing), and with my initial code taking at least a minute for relatively small values, I can't really afford this.
I heard finding the nearest neighbor may be the best way, and ideally, cutting down the keys used to a range of +- a certain amount would be good, but I don't know how you'd do that when there's more the one point being used.Here's how I'd do it with my current knowledge:
dimensions = 3
minimumDistance = 0.9
#example dictionary + input
dictionary[(0,0,0)]=[]
dictionary[(0,0,1)]=[]
keyToAdd = [0,1,1]
closestMatch = 2**1000
tooClose = False
for keys in dictionary:
#calculate distance to new point
originalCoordinates = str(split( dictionary[keys], "," ) ).replace("(","").replace(")","")
for i in range(dimensions):
distanceToPoint = #do pythagors with originalCoordinates and keyToAdd
#if you want the overall closest match
if distanceToPoint < closestMatch:
closestMatch = distanceToPoint
#if you want to just check it's not within that radius
if distanceToPoint < minimumDistance:
tooClose = True
break
However, performing calculations this way may still run very slow (it must do this to millions of values). I've searched the problem, but most people seem to have simpler sets of data to do this to. If anyone can offer any tips I'd be grateful.
You say you need to determine IF there are any keys within a given radius of a particular point. Thus, you only need to scan the keys, computing the distance of each to the point until you find one within the specified radius. (And if you do comparisons to the square of the radius, you can avoid the square roots needed for the actual distance.)
One optimization would be to sort the keys based on their "Manhattan distance" from the point (that is, add the component offsets), since the Euclidean distance will never be less than this. This would avoid some of the more expensive calculations (though I don't think you need and trigonometry).
If, as you suggest later in the question, you need to handle multiple points, you can obviously process each individually, or you could find the center of those points and sort based on that.

Python: sliding window of variable width

I'm writing a program in Python that's processing some data generated during experiments, and it needs to estimate the slope of the data. I've written a piece of code that does this quite nicely, but it's horribly slow (and I'm not very patient). Let me explain how this code works:
1) It grabs a small piece of data of size dx (starting with 3 datapoints)
2) It evaluates whether the difference (i.e. |y(x+dx)-y(x-dx)| ) is larger than a certain minimum value (40x std. dev. of noise)
3) If the difference is large enough, it will calculate the slope using OLS regression. If the difference is too small, it will increase dx and redo the loop with this new dx
4) This continues for all the datapoints
[See updated code further down]
For a datasize of about 100k measurements, this takes about 40 minutes, whereas the rest of the program (it does more processing than just this bit) takes about 10 seconds. I am certain there is a much more efficient way of doing these operations, could you guys please help me out?
Thanks
EDIT:
Ok, so I've got the problem solved by using only binary searches, limiting the number of allowed steps by 200. I thank everyone for their input and I selected the answer that helped me most.
FINAL UPDATED CODE:
def slope(self, data, time):
(wave1, wave2) = wt.dwt(data, "db3")
std = 2*np.std(wave2)
e = std/0.05
de = 5*std
N = len(data)
slopes = np.ones(shape=(N,))
data2 = np.concatenate((-data[::-1]+2*data[0], data, -data[::-1]+2*data[N-1]))
time2 = np.concatenate((-time[::-1]+2*time[0], time, -time[::-1]+2*time[N-1]))
for n in xrange(N+1, 2*N):
left = N+1
right = 2*N
for i in xrange(200):
mid = int(0.5*(left+right))
diff = np.abs(data2[n-mid+N]-data2[n+mid-N])
if diff >= e:
if diff < e + de:
break
right = mid - 1
continue
left = mid + 1
leftlim = n - mid + N
rightlim = n + mid - N
y = data2[leftlim:rightlim:int(0.05*(rightlim-leftlim)+1)]
x = time2[leftlim:rightlim:int(0.05*(rightlim-leftlim)+1)]
xavg = np.average(x)
yavg = np.average(y)
xlen = len(x)
slopes[n-N] = (np.dot(x,y)-xavg*yavg*xlen)/(np.dot(x,x)-xavg*xavg*xlen)
return np.array(slopes)
Your comments suggest that you need to find a better method to estimate ik+1 given ik. No knowledge of values in data would yield to the naive algorithm:
At each iteration for n, leave i at previous value, and see if the abs(data[start]-data[end]) value is less than e. If it is, leave i at its previous value, and find your new one by incrementing it by 1 as you do now. If it is greater, or equal, do a binary search on i to find the appropriate value. You can possibly do a binary search forwards, but finding a good candidate upper limit without knowledge of data can prove to be difficult. This algorithm won't perform worse than your current estimation method.
If you know that data is kind of smooth (no sudden jumps, and hence a smooth plot for all i values) and monotonically increasing, you can replace the binary search with a search backwards by decrementing its value by 1 instead.
How to optimize this will depend on some properties of your data, but here are some ideas:
Have you tried profiling the code? Using one of the Python profilers can give you some useful information about what's taking the most time. Often, a piece of code you've just written will have one biggest bottleneck, and it's not always obvious which piece it is; profiling lets you figure that out and attack the main bottleneck first.
Do you know what typical values of i are? If you have some idea, you can speed things up by starting with i greater than 0 (as #vhallac noted), or by increasing i by larger amounts — if you often see big values for i, increase i by 2 or 3 at a time; if the distribution of is has a long tail, try doubling it each time; etc.
Do you need all the data when doing the least squares regression? If that function call is the bottleneck, you may be able to speed it up by using only some of the data in the range. Suppose, for instance, that at a particular point, you need i to be 200 to see a large enough (above-noise) change in the data. But you may not need all 400 points to get a good estimate of the slope — just using 10 or 20 points, evenly spaced in the start:end range, may be sufficient, and might speed up the code a lot.
I work with Python for similar analyses, and have a few suggestions to make. I didn't look at the details of your code, just to your problem statement:
1) It grabs a small piece of data of size dx (starting with 3
datapoints)
2) It evaluates whether the difference (i.e. |y(x+dx)-y(x-dx)| ) is
larger than a certain minimum value (40x std. dev. of noise)
3) If the difference is large enough, it will calculate the slope
using OLS regression. If the difference is too small, it will increase
dx and redo the loop with this new dx
4) This continues for all the datapoints
I think the more obvious reason for slow execution is the LOOPING nature of your code, when perhaps you could use the VECTORIZED (array-based operations) nature of Numpy.
For step 1, instead of taking pairs of points, you can perform directly `data[3:] - data[-3:] and get all the differences in a single array operation;
For step 2, you can use the result from array-based tests like numpy.argwhere(data > threshold) instead of testing every element inside some loop;
Step 3 sounds conceptually wrong to me. You say that if the difference is too small, it will increase dx. But if the difference is small, the resulting slope would be small because it IS actually small. Then, getting a small value is the right result, and artificially increasing dx to get a "better" result might not be what you want. Well, it might actually be what you want, but you should consider this. I would suggest that you calculate the slope for a fixed dx across the whole data, and then take the resulting array of slopes to select your regions of interest (for example, using data_slope[numpy.argwhere(data_slope > minimum_slope)].
Hope this helps!

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