How to approach machine learning problems with high dimensional input space? - machine-learning

How should I approach a situtation when I try to apply some ML algorithm (classification, to be more specific, SVM in particular) over some high dimensional input, and the results I get are not quite satisfactory?
1, 2 or 3 dimensional data can be visualized, along with the algorithm's results, so you can get the hang of what's going on, and have some idea how to aproach the problem. Once the data is over 3 dimensions, other than intuitively playing around with the parameters I am not really sure how to attack it?

What do you do to the data? My answer: nothing. SVMs are designed to handle high-dimensional data. I'm working on a research problem right now that involves supervised classification using SVMs. Along with finding sources on the Internet, I did my own experiments on the impact of dimensionality reduction prior to classification. Preprocessing the features using PCA/LDA did not significantly increase classification accuracy of the SVM.
To me, this totally makes sense from the way SVMs work. Let x be an m-dimensional feature vector. Let y = Ax where y is in R^n and x is in R^m for n < m, i.e., y is x projected onto a space of lower dimension. If the classes Y1 and Y2 are linearly separable in R^n, then the corresponding classes X1 and X2 are linearly separable in R^m. Therefore, the original subspaces should be "at least" as separable as their projections onto lower dimensions, i.e., PCA should not help, in theory.
Here is one discussion that debates the use of PCA before SVM: link
What you can do is change your SVM parameters. For example, with libsvm link, the parameters C and gamma are crucially important to classification success. The libsvm faq, particularly this entry link, contains more helpful tips. Among them:
Scale your features before classification.
Try to obtain balanced classes. If impossible, then penalize one class more than the other. See more references on SVM imbalance.
Check the SVM parameters. Try many combinations to arrive at the best one.
Use the RBF kernel first. It almost always works best (computationally speaking).
Almost forgot... before testing, cross validate!
EDIT: Let me just add this "data point." I recently did another large-scale experiment using the SVM with PCA preprocessing on four exclusive data sets. PCA did not improve the classification results for any choice of reduced dimensionality. The original data with simple diagonal scaling (for each feature, subtract mean and divide by standard deviation) performed better. I'm not making any broad conclusion -- just sharing this one experiment. Maybe on different data, PCA can help.

Some suggestions:
Project data (just for visualization) to a lower-dimensional space (using PCA or MDS or whatever makes sense for your data)
Try to understand why learning fails. Do you think it overfits? Do you think you have enough data? Is it possible there isn't enough information in your features to solve the task you are trying to solve? There are ways to answer each of these questions without visualizing the data.
Also, if you tell us what the task is and what your SVM output is, there may be more specific suggestions people could make.

You can try reducing the dimensionality of the problem by PCA or the similar technique. Beware that PCA has two important points. (1) It assumes that the data it is applied to is normally distributed and (2) the resulting data looses its natural meaning (resulting in a blackbox). If you can live with that, try it.
Another option is to try several parameter selection algorithms. Since SVM's were already mentioned here, you might try the approach of Chang and Li (Feature Ranking Using Linear SVM) in which they used linear SVM to pre-select "interesting features" and then used RBF - based SVM on the selected features. If you are familiar with Orange, a python data mining library, you will be able to code this method in less than an hour. Note that this is a greedy approach which, due to its "greediness" might fail in cases where the input variables are highly correlated. In that case, and if you cannot solve this problem with PCA (see above), you might want to go to heuristic methods, which try to select best possible combinations of predictors. The main pitfall of this kind of approaches is the high potential of overfitting. Make sure you have a bunch "virgin" data that was not seen during the entire process of model building. Test your model on that data only once, after you are sure that the model is ready. If you fail, don't use this data once more to validate another model, you will have to find a new data set. Otherwise you won't be sure that you didn't overfit once more.
List of selected papers on parameter selection:
Feature selection for high-dimensional genomic microarray data
Oh, and one more thing about SVM. SVM is a black box. You better figure out what is the mechanism that generate the data and model the mechanism and not the data. On the other hand, if this would be possible, most probably you wouldn't be here asking this question (and I wouldn't be so bitter about overfitting).
List of selected papers on parameter selection
Feature selection for high-dimensional genomic microarray data
Wrappers for feature subset selection
Parameter selection in particle swarm optimization
I worked in the laboratory that developed this Stochastic method to determine, in silico, the drug like character of molecules

I would approach the problem as follows:
What do you mean by "the results I get are not quite satisfactory"?
If the classification rate on the training data is unsatisfactory, it implies that either
You have outliers in your training data (data that is misclassified). In this case you can try algorithms such as RANSAC to deal with it.
Your model(SVM in this case) is not well suited for this problem. This can be diagnozed by trying other models (adaboost etc.) or adding more parameters to your current model.
The representation of the data is not well suited for your classification task. In this case preprocessing the data with feature selection or dimensionality reduction techniques would help
If the classification rate on the test data is unsatisfactory, it implies that your model overfits the data:
Either your model is too complex(too many parameters) and it needs to be constrained further,
Or you trained it on a training set which is too small and you need more data
Of course it may be a mixture of the above elements. These are all "blind" methods to attack the problem. In order to gain more insight into the problem you may use visualization methods by projecting the data into lower dimensions or look for models which are suited better to the problem domain as you understand it (for example if you know the data is normally distributed you can use GMMs to model the data ...)

If I'm not wrong, you are trying to see which parameters to the SVM gives you the best result. Your problem is model/curve fitting.
I worked on a similar problem couple of years ago. There are tons of libraries and algos to do the same. I used Newton-Raphson's algorithm and a variation of genetic algorithm to fit the curve.
Generate/guess/get the result you are hoping for, through real world experiment (or if you are doing simple classification, just do it yourself). Compare this with the output of your SVM. The algos I mentioned earlier reiterates this process till the result of your model(SVM in this case) somewhat matches the expected values (note that this process would take some time based your problem/data size.. it took about 2 months for me on a 140 node beowulf cluster).
If you choose to go with Newton-Raphson's, this might be a good place to start.

Related

an algorithm for clustering visually separable clusters

I have visualized a dataset in 2D after employing PCA. 1 dimension is time and the Y dimension is First PCA component. As figure shows, there is relatively good separation between points (A, B). But unfortunately clustering methods (DBSCAN, SMO, KMEANS, Hierarchical) are not able to cluster these points in 2 clusters. As you see in section A there is a relative continuity and this continuous process is finished and Section B starts and there is rather big gap in comparison to past data between A and B.
I will be so grateful if you can introduce me any method and algorithm (or devising any metric from data considering its distribution) to be able to do separation between A and B without visualization. Thank you so much.
This is plot of 2 PCA components for the above plot(the first one). The other one is also the plot of components of other dataset which I get bad result,too.
This is a time series, and apparently you are looking for change points or want to segment this time series.
Do not treat this data set as a two dimensional x-y data set, and don't use clustering here; rather choose an algorithm that is actually designed for time series.
As a starter, plot series[x] - series[x-1], i.e. the first derivative. You may need to remove seasonality to improve results. No clustering algorithm will do this, they do not have a notion of seasonality or time.
If PCA gives you a good separation, you can just try to cluster after projecting your data through your PCA eigenvectors. If you don't want to use PCA, then you will need anyway an alternative data projection method, because failing clustering methods imply that your data is not separable in the original dimensions. You can take a look at non linear clustering methods such as the kernel based ones or spectral clustering for example. Or to define your own non-euclidian metric, which is in fact just another data projection method.
But using PCA clearly seems to be the best fit in your case (Occam razor : use the simplest model that fits your data).
I don't know that you'll have an easy time devising an algorithm to handle this case, which is dangerously (by present capabilities) close to "read my mind" clustering. You have a significant alley where you've marked the division. You have one nearly as good around (1700, +1/3), and an isolate near (1850, 0.45). These will make it hard to convince a general-use algorithm to make exactly one division at the spot you want, although that one is (I think) still the most computationally obvious.
Spectral clustering works well at finding gaps; I'd try that first. You might have to ask it for 3 or 4 clusters to separate the one you want in general. You could also try playing with SVM (good at finding alleys in data), but doing that in an unsupervised context is the tricky part.
No, KMeans is not going to work; it isn't sensitive to density or connectivity.

Are high values for c or gamma problematic when using an RBF kernel SVM?

I'm using WEKA/LibSVM to train a classifier for a term extraction system. My data is not linearly separable, so I used an RBF kernel instead of a linear one.
I followed the guide from Hsu et al. and iterated over several values for both c and gamma. The parameters which worked best for classifying known terms (test and training material differ of course) are rather high, c=2^10 and gamma=2^3.
So far the high parameters seem to work ok, yet I wonder if they may cause any problems further on, especially regarding overfitting. I plan to do another evaluation by extracting new terms, yet those are costly as I need human judges.
Could anything still be wrong with my parameters, even if both evaluation turns out positive? Do I perhaps need another kernel type?
Thank you very much!
In general you have to perform cross validation to answer whether the parameters are all right or do they lead to the overfitting.
From the "intuition" perspective - it seems like highly overfitted model. High value of gamma means that your Gaussians are very narrow (condensed around each poinT) which combined with high C value will result in memorizing most of the training set. If you check out the number of support vectors I would not be surprised if it would be the 50% of your whole data. Other possible explanation is that you did not scale your data. Most ML methods, especially SVM, requires data to be properly preprocessed. This means in particular, that you should normalize (standarize) the input data so it is more or less contained in the unit sphere.
RBF seems like a reasonable choice so I would keep using it. A high value of gamma is not necessary a bad thing, it would depends on the scale where your data lives. While a high C value can lead to overfitting, it would also be affected by the scale so in some cases it might be just fine.
If you think that your dataset is a good representation of the whole data, then you could use crossvalidation to test your parameters and have some peace of mind.

Machine learning: Which algorithm is used to identify relevant features in a training set?

I've got a problem where I've potentially got a huge number of features. Essentially a mountain of data points (for discussion let's say it's in the millions of features). I don't know what data points are useful and what are irrelevant to a given outcome (I guess 1% are relevant and 99% are irrelevant).
I do have the data points and the final outcome (a binary result). I'm interested in reducing the feature set so that I can identify the most useful set of data points to collect to train future classification algorithms.
My current data set is huge, and I can't generate as many training examples with the mountain of data as I could if I were to identify the relevant features, cut down how many data points I collect, and increase the number of training examples. I expect that I would get better classifiers with more training examples given fewer feature data points (while maintaining the relevant ones).
What machine learning algorithms should I focus on to, first,
identify the features that are relevant to the outcome?
From some reading I've done it seems like SVM provides weighting per feature that I can use to identify the most highly scored features. Can anyone confirm this? Expand on the explanation? Or should I be thinking along another line?
Feature weights in a linear model (logistic regression, naive Bayes, etc) can be thought of as measures of importance, provided your features are all on the same scale.
Your model can be combined with a regularizer for learning that penalises certain kinds of feature vectors (essentially folding feature selection into the classification problem). L1 regularized logistic regression sounds like it would be perfect for what you want.
Maybe you can use PCA or Maximum entropy algorithm in order to reduce the data set...
You can go for Chi-Square tests or Entropy depending on your data type. Supervized discretization highly reduces the size of your data in a smart way (take a look into Recursive Minimal Entropy Partitioning algorithm proposed by Fayyad & Irani).
If you work in R, the SIS package has a function that will do this for you.
If you want to do things the hard way, what you want to do is feature screening, a massive preliminary dimension reduction before you do feature selection and model selection from a sane-sized set of features. Figuring out what is the sane-size can be tricky, and I don't have a magic answer for that, but you can prioritize what order you'd want to include the features by
1) for each feature, split the data in two groups by the binary response
2) find the Komogorov-Smirnov statistic comparing the two sets
The features with the highest KS statistic are most useful in modeling.
There's a paper "out there" titled "A selctive overview of feature screening for ultrahigh-dimensional data" by Liu, Zhong, and Li, I'm sure a free copy is floating around the web somewhere.
4 years later I'm now halfway through a PhD in this field and I want to add that the definition of a feature is not always simple. In the case that your features are a single column in your dataset, the answers here apply quite well.
However, take the case of an image being processed by a convolutional neural network, for example, a feature is not one pixel of the input, rather it's much more conceptual than that. Here's a nice discussion for the case of images:
https://medium.com/#ageitgey/machine-learning-is-fun-part-3-deep-learning-and-convolutional-neural-networks-f40359318721

Machine Learning Algorithm selection

I am new in machine learning. My problem is to make a machine to select a university for the student according to his location and area of interest. i.e it should select the university in the same city as in the address of the student. I am confused in selection of the algorithm can I use Perceptron algorithm for this task.
There are no hard rules as to which machine learning algorithm is the best for which task. Your best bet is to try several and see which one achieves the best results. You can use the Weka toolkit, which implements a lot of different machine learning algorithms. And yes, you can use the perceptron algorithm for your problem -- but that is not to say that you would achieve good results with it.
From your description it sounds like the problem you're trying to solve doesn't really require machine learning. If all you want to do is match a student with the closest university that offers a course in the student's area of interest, you can do this without any learning.
I second the first remark that you probably don't need machine learning if the student has to live in the same area as the university. If you want to use an ML algorithm, maybe it would best to think about what data you would have to start with. The thing that comes to mind is a vector for a university that has certain subjects/areas for each feature. Then compute a distance from a vector which is like an ideal feature vector for the student. Minimize this distance.
The first and formost thing you need is a labeled dataset.
It sounds like the problem could be decomposed into a ML problem however you first need a set of positive and negative examples to train from.
How big is your dataset? What features do you have available? Once you answer these questions you can select an algorithm that bests fits the features of your data.
I would suggest using decision trees for this problem which resembles a set of if else rules. You can just take the location and area of interest of the student as conditions of if and else if statements and then suggest a university for him. Since its a direct mapping of inputs to outputs, rule based solution would work and there is no learning required here.
Maybe you can use a "recommender system"or a clustering approach , you can investigate more deeply the techniques like "collaborative filtering"(recommender system) or k-means(clustering) but again, as some people said, first you need data to learn from, and maybe your problem can be solved without ML.
Well, there is no straightforward and sure-shot answer to this question. The answer depends on many factors like the problem statement and the kind of output you want, type and size of the data, the available computational time, number of features, and observations in the data, to name a few.
Size of the training data
Accuracy and/or Interpretability of the output
Accuracy of a model means that the function predicts a response value for a given observation, which is close to the true response value for that observation. A highly interpretable algorithm (restrictive models like Linear Regression) means that one can easily understand how any individual predictor is associated with the response while the flexible models give higher accuracy at the cost of low interpretability.
Speed or Training time
Higher accuracy typically means higher training time. Also, algorithms require more time to train on large training data. In real-world applications, the choice of algorithm is driven by these two factors predominantly.
Algorithms like Naïve Bayes and Linear and Logistic regression are easy to implement and quick to run. Algorithms like SVM, which involve tuning of parameters, Neural networks with high convergence time, and random forests, need a lot of time to train the data.
Linearity
Many algorithms work on the assumption that classes can be separated by a straight line (or its higher-dimensional analog). Examples include logistic regression and support vector machines. Linear regression algorithms assume that data trends follow a straight line. If the data is linear, then these algorithms perform quite good.
Number of features
The dataset may have a large number of features that may not all be relevant and significant. For a certain type of data, such as genetics or textual, the number of features can be very large compared to the number of data points.

Which machine learning classifier to choose, in general? [closed]

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Suppose I'm working on some classification problem. (Fraud detection and comment spam are two problems I'm working on right now, but I'm curious about any classification task in general.)
How do I know which classifier I should use?
Decision tree
SVM
Bayesian
Neural network
K-nearest neighbors
Q-learning
Genetic algorithm
Markov decision processes
Convolutional neural networks
Linear regression or logistic regression
Boosting, bagging, ensambling
Random hill climbing or simulated annealing
...
In which cases is one of these the "natural" first choice, and what are the principles for choosing that one?
Examples of the type of answers I'm looking for (from Manning et al.'s Introduction to Information Retrieval book):
a. If your data is labeled, but you only have a limited amount, you should use a classifier with high bias (for example, Naive Bayes).
I'm guessing this is because a higher-bias classifier will have lower variance, which is good because of the small amount of data.
b. If you have a ton of data, then the classifier doesn't really matter so much, so you should probably just choose a classifier with good scalability.
What are other guidelines? Even answers like "if you'll have to explain your model to some upper management person, then maybe you should use a decision tree, since the decision rules are fairly transparent" are good. I care less about implementation/library issues, though.
Also, for a somewhat separate question, besides standard Bayesian classifiers, are there 'standard state-of-the-art' methods for comment spam detection (as opposed to email spam)?
First of all, you need to identify your problem. It depends upon what kind of data you have and what your desired task is.
If you are Predicting Category :
You have Labeled Data
You need to follow Classification Approach and its algorithms
You don't have Labeled Data
You need to go for Clustering Approach
If you are Predicting Quantity :
You need to go for Regression Approach
Otherwise
You can go for Dimensionality Reduction Approach
There are different algorithms within each approach mentioned above. The choice of a particular algorithm depends upon the size of the dataset.
Source: http://scikit-learn.org/stable/tutorial/machine_learning_map/
Model selection using cross validation may be what you need.
Cross validation
What you do is simply to split your dataset into k non-overlapping subsets (folds), train a model using k-1 folds and predict its performance using the fold you left out. This you do for each possible combination of folds (first leave 1st fold out, then 2nd, ... , then kth, and train with the remaining folds). After finishing, you estimate the mean performance of all folds (maybe also the variance/standard deviation of the performance).
How to choose the parameter k depends on the time you have. Usual values for k are 3, 5, 10 or even N, where N is the size of your data (that's the same as leave-one-out cross validation). I prefer 5 or 10.
Model selection
Let's say you have 5 methods (ANN, SVM, KNN, etc) and 10 parameter combinations for each method (depending on the method). You simply have to run cross validation for each method and parameter combination (5 * 10 = 50) and select the best model, method and parameters. Then you re-train with the best method and parameters on all your data and you have your final model.
There are some more things to say. If, for example, you use a lot of methods and parameter combinations for each, it's very likely you will overfit. In cases like these, you have to use nested cross validation.
Nested cross validation
In nested cross validation, you perform cross validation on the model selection algorithm.
Again, you first split your data into k folds. After each step, you choose k-1 as your training data and the remaining one as your test data. Then you run model selection (the procedure I explained above) for each possible combination of those k folds. After finishing this, you will have k models, one for each combination of folds. After that, you test each model with the remaining test data and choose the best one. Again, after having the last model you train a new one with the same method and parameters on all the data you have. That's your final model.
Of course, there are many variations of these methods and other things I didn't mention. If you need more information about these look for some publications about these topics.
The book "OpenCV" has a great two pages on this on pages 462-463. Searching the Amazon preview for the word "discriminative" (probably google books also) will let you see the pages in question. These two pages are the greatest gem I have found in this book.
In short:
Boosting - often effective when a large amount of training data is available.
Random trees - often very effective and can also perform regression.
K-nearest neighbors - simplest thing you can do, often effective but slow and requires lots of memory.
Neural networks - Slow to train but very fast to run, still optimal performer for letter recognition.
SVM - Among the best with limited data, but losing against boosting or random trees only when large data sets are available.
Things you might consider in choosing which algorithm to use would include:
Do you need to train incrementally (as opposed to batched)?
If you need to update your classifier with new data frequently (or you have tons of data), you'll probably want to use Bayesian. Neural nets and SVM need to work on the training data in one go.
Is your data composed of categorical only, or numeric only, or both?
I think Bayesian works best with categorical/binomial data. Decision trees can't predict numerical values.
Does you or your audience need to understand how the classifier works?
Use Bayesian or decision trees, since these can be easily explained to most people. Neural networks and SVM are "black boxes" in the sense that you can't really see how they are classifying data.
How much classification speed do you need?
SVM's are fast when it comes to classifying since they only need to determine which side of the "line" your data is on. Decision trees can be slow especially when they're complex (e.g. lots of branches).
Complexity.
Neural nets and SVMs can handle complex non-linear classification.
As Prof Andrew Ng often states: always begin by implementing a rough, dirty algorithm, and then iteratively refine it.
For classification, Naive Bayes is a good starter, as it has good performances, is highly scalable and can adapt to almost any kind of classification task. Also 1NN (K-Nearest Neighbours with only 1 neighbour) is a no-hassle best fit algorithm (because the data will be the model, and thus you don't have to care about the dimensionality fit of your decision boundary), the only issue is the computation cost (quadratic because you need to compute the distance matrix, so it may not be a good fit for high dimensional data).
Another good starter algorithm is the Random Forests (composed of decision trees), this is highly scalable to any number of dimensions and has generally quite acceptable performances. Then finally, there are genetic algorithms, which scale admirably well to any dimension and any data with minimal knowledge of the data itself, with the most minimal and simplest implementation being the microbial genetic algorithm (only one line of C code! by Inman Harvey in 1996), and one of the most complex being CMA-ES and MOGA/e-MOEA.
And remember that, often, you can't really know what will work best on your data before you try the algorithms for real.
As a side-note, if you want a theoretical framework to test your hypothesis and algorithms theoretical performances for a given problem, you can use the PAC (Probably approximately correct) learning framework (beware: it's very abstract and complex!), but to summary, the gist of PAC learning says that you should use the less complex, but complex enough (complexity being the maximum dimensionality that the algo can fit) algorithm that can fit your data. In other words, use the Occam's razor.
Sam Roweis used to say that you should try naive Bayes, logistic regression, k-nearest neighbour and Fisher's linear discriminant before anything else.
My take on it is that you always run the basic classifiers first to get some sense of your data. More often than not (in my experience at least) they've been good enough.
So, if you have supervised data, train a Naive Bayes classifier. If you have unsupervised data, you can try k-means clustering.
Another resource is one of the lecture videos of the series of videos Stanford Machine Learning, which I watched a while back. In video 4 or 5, I think, the lecturer discusses some generally accepted conventions when training classifiers, advantages/tradeoffs, etc.
You should always keep into account the inference vs prediction trade-off.
If you want to understand the complex relationship that is occurring in your data then you should go with a rich inference algorithm (e.g. linear regression or lasso). On the other hand, if you are only interested in the result you can go with high dimensional and more complex (but less interpretable) algorithms, like neural networks.
Selection of Algorithm is depending upon the scenario and the type and size of data set.
There are many other factors.
This is a brief cheat sheet for basic machine learning.

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