ckmeans divide and conquer technique - r

I was going through the ckmeans algorithm https://journal.r-project.org/archive/2011-2/RJournal_2011-2_Wang+Song.pdf
I understood the Dynamic Programming approach to fill the matrices and get clusters. The time complexity is O(kn^2) as described in above PDF.
An improvement of this algorithm exists, which uses divide and conquer technique to fill the matrices. Time complexity reduces to O(knlog(n)) I am unable to understand it from the code that exists for it https://github.com/simple-statistics/simple-statistics/blob/master/src/ckmeans.js
I have understood most of it, but the part where actual log(n) part comes. i.e from line L95 to L123
Please help just understand the gist of what is happening here.

Related

Understanding the complex-step in a physical sense

I think I understand what complex step is doing numerically/algorithmically.
But the questions still linger. First two questions might have the same answer.
1- I replaced the partial derivative calculations of 'Betz_limit' example with complex step and removed the analytical gradients. Looking at the recorded design_var evolution none of the values are complex? Aren't they supposed to be shown as somehow a+bi?
Or it always steps in the real space. ?
2- Tying to picture 'cs', used in a physical concept. For example a design variable of beam length (m), objective of mass (kg) and a constraint of loads (Nm). I could be using an explicit component to calculate these (pure python) or an external code component (pure fortran). Numerically they all can handle complex numbers but obviously the mass is a real value. So when we say capable of handling the complex numbers is it just an issue of handling a+bi (where actual mass is always 'a' and b is always equal to 0?)
3- How about the step size. I understand there wont be any subtractive cancellation errors but what if i have a design variable normalized/scaled to 1 and a range of 0.8 to 1.2. Decreasing the step to 1e-10 does not make sense. I am a bit confused there.
The ability to use complex arithmetic to compute derivative approximations is based on the mathematics of complex arithmetic.
You should read about the theory to get a better understanding of why it works and how the step size issue is resolved with complex-step vs finite-difference.
There is no physical interpretation that you can make for the complex-step method. You are simply taking advantage of the mathematical properties of complex arithmetic to approximate a derivative in a more accurate manner than FD can. So the key is that your code is set up to do complex-arithmetic correctly.
Sometimes, engineering analyses do actually leverage complex numbers. One aerospace example of this is the Jukowski Transformation. In electrical engineering, complex numbers come up all the time for load-flow analysis of ac circuits. If you have such an analysis, then you can not easily use complex-step to approximate derivatives since the analysis itself is already complex. In these cases, it is technically possible to use a more general class of numbers called hyper dual numbers, but this is not supported in OpenMDAO. So if you had an analysis like this you could not use complex-step.
Also, occationally there are implementations of methods that are not complex-step safe which will prevent you from using it unless you define a new complex-step safe version. The simplest example of this is the np.absolute() method in the numpy library for python. The implementation of this, when passed a complex number, will return the asolute magnitude of the number:
abs(a+bj) = sqrt(1^2 + 1^2) = 1.4142
While not mathematically incorrect, this implementation would mess up the complex-step derivative approximation.
Instead you need an alternate version that gives:
abs(a+bj) = abs(a) + abs(b)*j
So in summary, you need to watch out for these kinds of functions that are not implemented correctly for use with complex-step. If you have those functions, you need to use alternate complex-step safe versions of them. Also, if your analysis itself uses complex numbers then you can not use complex-step derivative approximations either.
With regard to your step size question, again I refer you to the this paper for greater detail. The basic idea is that without subtractive cancellation you are free to use a very small step size with complex-step without the fear of lost accuracy due to numerical issues. So typically you will use 1e-20 smaller as the step. Since complex-step accuracy scalea with the order of step^2, using such a small step gives effectively exact results. You need not worry about scaling issues in most cases, if you just take a small enough step.

A variant of the 2D knapsack or square packing

I am dealing with an optimisation issue, which I classified as a combinatorial problem. Now, I know this is a 2D variant of the knapsack problem, but please bear with me:
If I have an area that is modeled as a grid comprised of equal size cells, how to place a certain number of square objects of different sizes, on this grid area, if every object has its cost and its benefit and the goal is to have an arrangement of the objects that has the maximum Benefit/Cost ratio:
Object 1: 1x1 square, cost = 800, value= 2478336
Object 2: 2x2 square cost= 2000 value = 7565257
Object 3: 3x3 square cost= 3150 value= 14363679
The object 3 has the best value/cost ratio, so the approach would be a greedy one I guess, to first place as much of the bigger squares as possible, but still there are many optimal solutions depending on the size of the area.
Also, the square objects cannot overlap.
I am using R for this, and the package adagio has algorithms for the single and multiple knapsack, but not for a 2D knapsack problem. Because I am very new in optimization and programming, I am not sure if there is way of solving this problem with R, can someone please help?
Thanks!
Firstly, I'm not an expert in R and adagio. Secondly, I think that your problem is not exactly 2d knapsack, it looks like a variant of packing problem, so it requires a different approach.
So, first, check this awesome list of R optimization packages, especially the following sections:
Specific Applications in Optimization (for example, tabu search could be useful for you)
Mathematical Programming Solvers/Interfaces to Open Source Optimizers (lpsolve definitely could solve your task)
Global and Stochastic Optimization (some of this packages could be used to solve your task)
In case if you're not tied to R, consider Minizinc as a solver. It's very easy to install/use and it's pretty efficient in terms of memory/time consumption. Moreover, there is a bunch of great examples how to use it.

A framework for comparing the time performance of Expectation Maximization

I have my own implementation of the Expectation Maximization (EM) algorithm based on this paper, and I would like to compare this with the performance of another implementation. For the tests, I am using k centroids with 1 Gb of txt data and I am just measuring the time it takes to compute the new centroids in 1 iteration. I tried it with an EM implementation in R, but I couldn't, since the result is plotted in a graph and gets stuck when there's a large number of txt data. I was following the examples in here.
Does anybody know of an implementation of EM that can measure its performance or know how to do it with R?
Fair benchmarking of EM is hard. Very hard.
the initialization will usually involve random, and can be very different. For all I know, the R implementation by default uses hierarchical clustering to find the initial clusters. Which comes at O(n^2) memory and most likely at O(n^3) runtime cost. In my benchmarks, R would run out of memory due to this. I assume there is a way to specify initial cluster centers/models. A random-objects initialization will of course be much faster. Probably k-means++ is a good way to choose initial centers in practise.
EM theoretically never terminates. It just at some point does not change much anymore, and thus you can set a threshold to stop. However, the exact definition of the stopping threshold varies.
There exist all kinds of model variations. A method only using fuzzy assignments such as Fuzzy-c-means will of course be much faster than an implementation using multivariate Gaussian Mixture Models with a covaraince matrix. In particular with higher dimensionality.
Covariance matrixes also need O(k * d^2) memory, and the inversion will take O(k * d^3) time, and thus is clearly not appropriate for text data.
Data may or may not be appropriate. If you run EM on a data set that actually has Gaussian clusters, it will usually work much better than on a data set that doesn't provide a good fit at all. When there is no good fit, you will see a high variance in runtime even with the same implementation.
For a starter, try running your own algorithm several times with different initialization, and check your runtime for variance. How large is the variance compared to the total runtime?
You can try benchmarking against the EM implementation in ELKI. But I doubt the implementation will work with sparse data such as text - that data just is not Gaussian, it is not proper to benchmark. Most likely it will not be able to process the data at all because of this. This is expected, and can be explained from theory. Try to find data sets that are dense and that can be expected to have multiple gaussian clusters (sorry, I can't give you many recommendations here. The classic Iris and Old Faithful data sets are too small to be useful for benchmarking.

Can any existing Machine Learning structures perfectly emulate recursive functions like the Fibonacci sequence?

To be clear I don't mean, provided the last two numbers in the sequence provide the next one:
(2, 3, -> 5)
But rather given any index provide the Fibonacci number:
(0 -> 1) or (7 -> 21) or (11 -> 144)
Adding two numbers is a very simple task for any machine learning structure, and by extension counting by ones, twos or any fixed number is a simple addition rule. Recursive calculations however...
To my understanding, most learning networks rely on forwards only evaluation, whereas most programming languages have loops, jumps, or circular flow patterns (all of which are usually ASM jumps of some kind), thus allowing recursion.
Sure some networks aren't forwards only; But can processing weights using the hyperbolic tangent or sigmoid function enter any computationally complete state?
i.e. conditional statements, conditional jumps, forced jumps, simple loops, complex loops with multiple conditions, providing sort order, actual reordering of elements, assignments, allocating extra registers, etc?
It would seem that even a non-forwards only network would only find a polynomial of best fit, reducing errors across the expanse of the training set and no further.
Am I missing something obvious, or did most of Machine Learning just look at recursion and pretend like those problems don't exist?
Update
Technically any programming language can be considered the DNA of a genetic algorithm, where the compiler (and possibly console out measurement) would be the fitness function.
The issue is that programming (so far) cannot be expressed in a hill climbing way - literally, the fitness is 0, until the fitness is 1. Things don't half work in programming, and if they do, there is no way of measuring how 'working' a program is for unknown situations. Even an off by one error could appear to be a totally different and chaotic system with no output. This is exactly the reason learning to code in the first place is so difficult, the learning curve is almost vertical.
Some might argue that you just need to provide stronger foundation rules for the system to exploit - but that just leads to attempting to generalize all programming problems, which circles right back to designing a programming language and loses all notion of some learning machine at all. Following this road brings you to a close variant of LISP with mutate-able code and virtually meaningless fitness functions that brute force the 'nice' and 'simple' looking code-space in attempt to follow human coding best practices.
Others might argue that we simply aren't using enough population or momentum to gain footing on the error surface, or make a meaningful step towards a solution. But as your population approaches the number of DNA permutations, you are really just brute forcing (and very inefficiently at that). Brute forcing code permutations is nothing new, and definitely not machine learning - it's actually quite common in regex golf, I think there's even an xkcd about it...
The real problem isn't finding a solution that works for some specific recursive function, but finding a solution space that can encompass the recursive domain in some useful way.
So other than Neural Networks trained using Backpropagation hypothetically finding the closed form of a recursive function (if a closed form even exists, and they don't in most real cases where recursion is useful), or a non-forwards only network acting like a pseudo-programming language with awful fitness prospects in the best case scenario, plus the virtually impossible task of tuning exit constraints to prevent infinite recursion... That's really it so far for machine learning and recursion?
According to Kolmogorov et al's On the representation of continuous functions of many variables by superposition of continuous functions of one variable and addition, a three layer neural network can model arbitrary function with the linear and logistic functions, including f(n) = ((1+sqrt(5))^n - (1-sqrt(5))^n) / (2^n * sqrt(5)), which is the close form solution of Fibonacci sequence.
If you would like to treat the problem as a recursive sequence without a closed-form solution, I would view it as a special sliding window approach (I called it special because your window size seems fixed as 2). There are more general studies on the proper window size for your interest. See these two posts:
Time Series Prediction via Neural Networks
Proper way of using recurrent neural network for time series analysis
Ok, where to start...
Firstly, you talk about 'machine learning' and 'perfectly emulate'. This is not generally the purpose of machine learning algorithms. They make informed guesses given some evidence and some general notions about structures that exist in the world. That typically means an approximate answer is better than an 'exact' one that is wrong. So, no, most existing machine learning approaches aren't the right tools to answer your question.
Second, you talk of 'recursive structures' as some sort of magic bullet. Yet they are merely convenient ways to represent functions, somewhat analogous to higher order differential equations. Because of the feedbacks they tend to introduce, the functions tend to be non-linear. Some machine learning approaches will have trouble with this, but many (neural networks for example) should be able to approximate you function quite well, given sufficient evidence.
As an aside, having or not having closed form solutions is somewhat irrelevant here. What matters is how well the function at hand fits with the assumptions embodied in the machine learning algorithm. That relationship may be complex (eg: try approximating fibbonacci with a support vector machine), but that's the essence.
Now, if you want a machine learning algorithm tailored to the search for exact representations of recursive structures, you could set up some assumptions and have your algorithm produce the most likely 'exact' recursive structure that fits your data. There are probably real world problems in which such a thing would be useful. Indeed the field of optimisation approaches similar problems.
The genetic algorithms mentioned in other answers could be an example of this, especially if you provided a 'genome' that matches the sort of recursive function you think you may be dealing with. Closed form primitives could form part of that space too, if you believe they are more likely to be 'exact' than more complex genetically generated algorithms.
Regarding your assertion that programming cannot be expressed in a hill climbing way, that doesn't prevent a learning algorithm from scoring possible solutions by how many much of your evidence it's able to reproduce and how complex they are. In many cases (most? though counting cases here isn't really possible) such an approach will find a correct answer. Sure, you can come up with pathological cases, but with those, there's little hope anyway.
Summing up, machine learning algorithms are not usually designed to tackle finding 'exact' solutions, so aren't the right tools as they stand. But, by embedding some prior assumptions that exact solutions are best, and perhaps the sort of exact solution you're after, you'll probably do pretty well with genetic algorithms, and likely also with algorithms like support vector machines.
I think you also sum things up nicely with this:
The real problem isn't finding a solution that works for some specific recursive function, but finding a solution space that can encompass the recursive domain in some useful way.
The other answers go a long way to telling you where the state of the art is. If you want more, a bright new research path lies ahead!
See this article:
Turing Machines are Recurrent Neural Networks
http://lipas.uwasa.fi/stes/step96/step96/hyotyniemi1/
The paper describes how a recurrent neural network can simulate a register machine, which is known to be a universal computational model equivalent to a Turing machine. The result is "academic" in the sense that the neurons have to be capable of computing with unbounded numbers. This works mathematically, but would have problems pragmatically.
Because the Fibonacci function is just one of many computable functions (in fact, it is primitive recursive), it could be computed by such a network.
Genetic algorithms should do be able to do the trick. The important this is (as always with GAs) the representation.
If you define the search space to be syntax trees representing arithmetic formulas and provide enough training data (as you would with any machine learning algorithm), it probably will converge to the closed-form solution for the Fibonacci numbers, which is:
Fib(n) = ( (1+srqt(5))^n - (1-sqrt(5))^n ) / ( 2^n * sqrt(5) )
[Source]
If you were asking for a machine learning algorithm to come up with the recursive formula to the Fibonacci numbers, then this should also be possible using the same method, but with individuals being syntax trees of a small program representing a function.
Of course, you also have to define good cross-over and mutation operators as well as a good evaluation function. And I have no idea how well it would converge, but it should at some point.
Edit: I'd also like to point out that in certain cases there is always a closed-form solution to a recursive function:
Like every sequence defined by a linear recurrence with constant coefficients, the Fibonacci numbers have a closed-form solution.
The Fibonacci sequence, where a specific index of the sequence must be returned, is often used as a benchmark problem in Genetic Programming research. In most cases recursive structures are generated, although my own research focused on imperative programs so used an iterative approach.
There's a brief review of other GP research that uses the Fibonacci problem in Section 3.4.2 of my PhD thesis, available here: http://kar.kent.ac.uk/34799/. The rest of the thesis also describes my own approach, which is covered a bit more succinctly in this paper: http://www.cs.kent.ac.uk/pubs/2012/3202/
Other notable research which used the Fibonacci problem is Simon Harding's work with Self-Modifying Cartesian GP (http://www.cartesiangp.co.uk/papers/eurogp2009-harding.pdf).

R function to solve large dense linear systems of equations?

Sorry, maybe I am blind, but I couldn't find anything specific for a rather common problem:
I want to implement
solve(A,b)
with
A
being a large square matrix in the sense that command above uses all my memory and issues an error (b is a vector with corresponding length). The matrix I have is not sparse in the sense that there would be large blocks of zero etc.
There must be some function out there which implements a stepwise iterative scheme such that a solution can be found even with limited memory available.
I found several posts on sparse matrix and, of course, the Matrix package, but could not identify a function which does what I need. I have also seen this post but
biglm
produces a complete linear model fit. All I need is a simple solve. I will have to repeat that step several times, so it would be great to keep it as slim as possible.
I already worry about the "duplication of an old issue" and "look here" comments, but I would be really grateful for some help.

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