Pairwise alignment of long string sequences - algorithm

I want to find the globally optimal (or close to optimal) pairwise alignment between two long (tens of thousands) sequences of strings, but the algorithm is expected to operate on any object sequences.
I also want to use my own distance function implementation to compute the similarity of two objects. For shorter sequences, I could use the dynamic time warping (DTW) algorithm but the DTW algorithm needs to compute and store a n*m distance matrix (n,m are lengths of the sequences) which is not feasible for longer sequences. Can you recommend such algorithm? A working implementation would be a plus.
The following example clarifies what the algorithm needs to do:
Input:
Sequence A: i saw the top of the mountain
Sequence B: then i see top of the mountains
Result:
Sequence A: i saw the top of the mountain
Sequence B: then i see top of the mountains

I don't know, if I understood your requirements right, but it sounds to me like you are trying to solve a Stable Marriage Problem. The original solution of Gale and Shapley in the link is in O(n*m) time and O(n+m) space, if my memory serves me right. The implementation was pretty straightforward.
There are also some later solutions with different variants of the problem.
You also could try to solve this problem by using Maximum Bipartite Graph Matching, e.g. here, for getting a different optimality criterion. This also can be done in O(n*m).

Related

Approximated closest pair algorithm

I have been thinking about a variation of the closest pair problem in which the only available information is the set of distances already calculated (we are not allowed to sort points according to their x-coordinates).
Consider 4 points (A, B, C, D), and the following distances:
dist(A,B) = 0.5
dist(A,C) = 5
dist(C,D) = 2
In this example, I don't need to evaluate dist(B,C) or dist(A,D), because it is guaranteed that these distances are greater than the current known minimum distance.
Is it possible to use this kind of information to reduce the O(n²) to something like O(nlogn)?
Is it possible to reduce the cost to something close to O(nlogn) if I accept a kind of approximated solution? In this case, I am thinking about some technique based on reinforcement learning that only converges to the real solution when the number of reinforcements go to infinite, but provides a great approximation for small n.
Processing time (measured by the big O notation) is not the only issue. To keep a very large amount of previous calculated distances can also be an issue.
Imagine this problem for a set with 10⁸ points.
What kind of solution should I look for? Was this kind of problem solved before?
This is not a classroom problem or something related. I have been just thinking about this problem.
I suggest using ideas that are derived from quickly solving k-nearest-neighbor searches.
The M-Tree data structure: (see http://en.wikipedia.org/wiki/M-tree and http://www.vldb.org/conf/1997/P426.PDF ) is designed to reduce the number distance comparisons that need to be performed to find "nearest neighbors".
Personally, I could not find an implementation of an M-Tree online that I was satisfied with (see my closed thread Looking for a mature M-Tree implementation) so I rolled my own.
My implementation is here: https://github.com/jon1van/MTreeMapRepo
Basically, this is binary tree in which each leaf node contains a HashMap of Keys that are "close" in some metric space you define.
I suggest using my code (or the idea behind it) to implement a solution in which you:
Search each leaf node's HashMap and find the closest pair of Keys within that small subset.
Return the closest pair of Keys when considering only the "winner" of each HashMap.
This style of solution would be a "divide and conquer" approach the returns an approximate solution.
You should know this code has an adjustable parameter the governs the maximum number of Keys that can be placed in an individual HashMap. Reducing this parameter will increase the speed of your search, but it will increase the probability that the correct solution won't be found because one Key is in HashMap A while the second Key is in HashMap B.
Also, each HashMap is associated a "radius". Depending on how accurate you want your result you maybe able to just search the HashMap with the largest hashMap.size()/radius (because this HashMap contains the highest density of points, thus it is a good search candidate)
Good Luck
If you only have sample distances, not original point locations in a plane you can operate on, then I suspect you are bounded at O(E).
Specifically, it would seem from your description that any valid solution would need to inspect every edge in order to rule out it having something interesting to say, meanwhile, inspecting every edge and taking the smallest solves the problem.
Planar versions bypass O(V^2), by using planar distances to deduce limitations on sets of edges, allowing us to avoid needing to look at most of the edge weights.
Use same idea as in space partitioning. Recursively split given set of points by choosing two points and dividing set in two parts, points that are closer to first point and points that are closer to second point. That is same as splitting points by a line passing between two chosen points.
That produces (binary) space partitioning, on which standard nearest neighbour search algorithms can be used.

Two algorithms to find nearest neighbor with Locality-sensitive hashing, which one?

Currently I'm studying how to find a nearest neighbor using Locality-sensitive hashing. However while I'm reading papers and searching the web I found two algorithms for doing this:
1- Use L number of hash tables with L number of random LSH functions, thus increasing the chance that two documents that are similar to get the same signature. For example if two documents are 80% similar, then there's an 80% chance that they will get the same signature from one LSH function. However if we use multiple LSH functions, then there's a higher chance to get the same signature for the documents from one of the LSH functions. This method is explained in wikipedia and I hope my understanding is correct:
http://en.wikipedia.org/wiki/Locality-sensitive_hashing#LSH_algorithm_for_nearest_neighbor_search
2- The other algorithm uses a method from a paper (section 5) called: Similarity Estimation Techniques from Rounding Algorithms by Moses S. Charikar. It's based on using one LSH function to generate the signature and then apply P permutations on it and then sort the list. Actually I don't understand the method very well and I hope if someone could clarify it.
My main question is: why would anyone use the second method rather than the first method? As I find it's easier and faster.
I really hope someone can help!!!
EDIT:
Actually I'm not sure if #Raff.Edward were mixing between the "first" and the "second". Because only the second method uses a radius and the first just uses a new hash family g composed of the hash family F. Please check the wikipedia link. They just used many g functions to generate different signatures and then for each g function it has a corresponding hash table. In order to find the nearest neighbor of a point you just let the point go through the g functions and check the corresponding hash tables for collisions. Thus how I understood it as more function ... more chance for collisions.
I didn't find any mentioning about radius for the first method.
For the second method they generate only one signature for each feature vector and then apply P permutations on them. Now we have P lists of permutations where each contains n signatures. Now they then sort each list from P. After that given a query point q, they generate the signature for it and then apply the P permutations on it and then use binary search on each permuted and sorted P list to find the most similar signature to the query q. I concluded this after reading many papers about it, but I still don't understand why would anyone use such a method because it doesn't seem fast in finding the hamming distance!!!!
For me I would simply do the following to find the nearest neighbor for a query point q. Given a list of signatures N, I would generate the signature for the query point q and then scan the list N and compute the hamming distance between each element in N and the signature of q. Thus I would end up with the nearest neighbor for q. And it takes O(N)!!!
Your understanding of the first one is a little off. The probability of a collision occurring is not proportional to the similarity, but whether or not it is less than the pre-defined radius. The goal is that anything within the radius will have a high chance of colliding, and anything outside the radius * (1+eps) will have a low chance of colliding (and the area in-between is a little murky).
The first algorithm is actually fairly difficult to implement well, but can get good results. In particular, the first algorithm is for the L1 and L2 (and technically a few more) metrics.
The second algorithm is very simple to implement, though a naive implementation may use up too much memory to be useful depending on your problem size. In this case, the probability of collision is proportional to the similarity of the inputs. However, it only works for the Cosine Similarity (or distance metrics based on a transform of the similarity.)
So which one you would use is based primarily on which distance metric you are using for Nearest Neighbor (or whatever other application).
The second one is actually much easier to understand and implement than the first one, the paper is just very wordy.
The short version: Take a random vector V and give each index a independent random unit normal value. Create as many vectors as you want the signature length to be. The signature is the signs of each index when you do a Matrix Vector product. Now the hamming distance between any two signatures is related to the cosine similarity between the respective data points.
Because you can encode the signature into an int array and use an XOR with a bit count instruction to get the hamming distance very quickly, you can get approximate cosine similarity scores very quickly.
LSH algorithms doesn't have a lot of standardization, and the two papers (and others) use different definitions, so its all a bit confusing at times. I only recently implemented both of these algorithms in JSAT, and am still working on fully understanding them both.
EDIT: Replying to your edit. The wikipedia article is not great for LSH. If you read the original paper, the first method you are talking about only works for a fixed radius. The hash functions are then created based on that radius, and concatenated to increase the probability of getting near by points in a collision. They then construct a system for doing k-NN on-top of this by determine the maximum value of k they wan, and then finding the largest reasonable distance they would find the k'th nearest neighbor in. In this way, a radius search will very likely return the set of k-NNs. To speed this up, they also create a few extra small radius since the density is often not uniform, and the smaller radius you use, the faster the results.
The wikipedia section you linked is taken from the paper description for the "Stable Distribution" section, which presents the hash function for a search of radius r=1.
For the second paper, the "sorting" you describe is not part of the hashing, but part of one-scheme for searching the hamming space more quickly. I as I mentioned, I recently implemented this, and you can see a quick benchmark I did using a brute force search is still much faster than the naive method of NN. Again, you would also pick this method if you need the cosine similarity over the L2 or L1 distance. You will find many other papers proposing different schemes for searching the hamming space created by the signatures.
If you need help convincing yourself fit can be faster even if you were still doing brute force - just look at it this way: Lets say that the average sparse document has 40 common words with another document (a very conservative number in my experience). You have n documents to compare against. Brute force cosine similarity would then involve about 40*n floating point multiplications (and some extra work). If you have a 1024 bit signature, thats only 32 integers. That means we could do a brute force LSH search in 32*n integer operations, which are considerably faster then floating point operations.
There are also other factors at play here as well. For a sparse data set we have to keep both the doubles and integer indices to represent the non zero indexes, so the sparse dot product is doing a lot of additional integer operations to see which indices they have in common. LSH also allows us to save memory, because we don't need to store all of these integers and doubles for each vector, instead we can just keep its hash around - which is only a few bytes.
Reduced memory use can help us better exploit the CPU cache.
Your O(n) is the naive way I have used in my blog post. And it is fast. However, if you sort the bits before hand, you can do the binary search in O(log(n)). Even if you have L of these lists, L << n, and so it should be faster. The only issue is it gets you approximate hamming NN which are already approximating the cosine similarity, so the results can become a bit worse. It depends on what you need.

String analysis

Given a sequence of operations:
a*b*a*b*a*a*b*a*b
is there a way to get the optimal subdivision to enable reusage of substring.
making
a*b*a*b*a*a*b*a*b => c*a*c, where c = a*b*a*b
and then seeing that
a*b*a*b => d*d, where d = a*b
all in all reducing the 8 initial operations into the 4 described here?
(c = (d = a*b)*d)*a*c
The goal of course is to minimize the number of operations
I'm considering a suffixtree of sorts.
I'm especially interested in linear time heuristics or solutions.
The '*' operations are actually matrix multiplications.
This whole problem is known as "Common Subexpression Elimination" or CSE. It is a slightly smaller version of the problem called "Graph Reduction" faced by the implementer of compilers for functional programming languages. Googling "Common Subexpression elimination algorithm" gives lots of solutions, though none that I can see especially for the constraints given by matrix multiplication.
The pages linked to give a lot of references.
My old answer is below. However, having researched a bit more, the solution is simply building a suffix tree. This can be done in O(N) time (lots of references on the wikipedia page). Having done this, the sub-expressions (c, d etc. in your question) are just nodes in the suffix tree - just pull them out.
However, I think MarcoS is on to something with the suggestion of Longest repeating Substring, as graph reduction precedence might not allow optimisations that can be allowed here.
sketch of algorithm:
optimise(s):
let sub = longestRepeatingSubstring(s).
optimisedSub = optimise(sub)
return s with sub replaced by optimisedSub
Each run of longest repeating substring takes time N. You can probably re-use the suffix tree you build to solve the whole thing in time N.
edit: The orders-of-growth in this answer are needed in addition to the accepted answer in order to run CSE or matrix-chain multiplication
Interestingly, a compression algorithm may be what you want: a compression algorithm seeks to reduce the size of what it's compressing, and if the only way it can do that is substitution, you can trace it and obtain the necessary subcomponents for your algorithm. This may not give nice results though for small inputs.
What subsets of your operations are commutative will be an important consideration in choosing such an algorithm. [edit: OP says no operations are commutative in his/her situation]
We can also define an optimal solution, if we ignore effects such as caching:
input: [some product of matrices to compute]
given that multiplying two NxN matrices is O(N^2.376)
given we can visualize the product as follows:
[[AxB][BxC][CxD][DxE]...]
we must for example perform O(max(A,B,C)^2.376) or so operations in order to combine
[AxB][BxC] -> [AxC]
The max(...) is an estimate based on how fast it is to multiply two square matrices;
a better estimate of cost(A,B,C) for multiplying an AxB * BxC matrix can be gotten
from actually looking at the algorithm, or running benchmarks if you don't know the
algorithm used.
However note that multiplying the same matrix with itself, i.e. calculating
a power, can be much more efficient, and we also need to take that into account.
At worst, it takes log_2(power) multiplies each of O(N^2.376), but this could be
made more efficient by diagonalizing the matrix first.
There is the question about whether a greedy approach is feasible for not: whether one SHOULD compress repeating substrings at each step. This may not be the case, e.g.
aaaaabaab
compressing 'aa' results in ccabcb and compressing 'aab' is now impossible
However I have a hunch that, if we try all orders of compressing substrings, we will probably not run into this issue too often.
Thus having written down what we want (the costs) and considered possibly issues, we already have a brute-force algorithm which can do this, and it will run for very small numbers of matrices:
# pseudocode
def compress(problem, substring)
x = new Problem(problem)
x.string.replaceall(substring, newsymbol)
x.subcomputations += Subcomputation(newsymbol=substring)
def bestCompression(problem)
candidateCompressions = [compress(problem,substring) for each substring in problem.string]
# etc., recursively return problem with minimum cost
# dynamic programming may help make this more efficient, but one must watch
# out for the note above, how it may be hard to be greedy
Note: according to another answer by Asgeir, this is known as the Matrix Chain Multiplication optimization problem. Nick Fortescue notes this is also known more generally as http://en.wikipedia.org/wiki/Common_subexpression_elimination -- thus one could find any generic CSE or Matrix-Chain-Multiplication algorithm/library from the literature, and plug in the cost orders-of-magnitude I mentioned earlier (you will need those nomatter which solution you use). Note that the cost of the above calculations (multiplication, exponentiation, etc.) assume that they are being done efficiently with state-of-the-art algorithms; if this is not the case, replace the exponents with appropriate values which correspond to the way the operations will be carried out.
If you want to use the fewest arithmetic operations then you should have a look at matrix chain multiplication which can be reduced to O(n log n)
From the top of the head the problem seems in NP for me. Depending on the substitutions you are doing other substitions will be possible or impossible for example for the string
d*e*a*b*c*d*e*a*b*c*d*e*a there are several possibilities.
If you take the longest common string it will be:
f = d*e*a*b*c and you could substitute f*f*e*a leaving you with three multiplications in the end and four intermediate ones (total seven).
If you instead substitute the following way:
f = d*e*a you get f*b*c*f*b*c*f which you can further substitute using g = f*b*c to
g*g*f for a total of six multiplication.
There are other possible substitutions in this problem, but I do not have the time to count them all right now.
I am guessing for a complete minimal substitution it is not only necessary to figure out the longest common substring but also the number of times each substring repeats, which probably means you have to track all substitutions so far and do backtracking. Still it might be faster than the actual multiplications.
Isn't this the Longest repeated substring problem?

Find the priority function / alphabet order for extreme higher order elements relation

This question is an extension to the following one. The difference is that now our function to optimize will have higher order relations between elements:
We have an array of elements a1,a2,...aN from an alphabet E. Assuming |N| >> |E|.
For each symbol of the alphabet we define an unique integer priority = V(sym). Let's define V{i} := V(symbol(ai)) for the simplicity.
The task is to find a priority function V for which:
Count(i)->MIN | V{i} > V{i+1} <= V{i+2}
In other words, I need to find the priorities / permutation of the alphabet for which the number of positions i, satisfying the condition V{i}>V{i+1}<=V{i+2}, is minimum.
Maximum required abstraction (low priority for me). I guess once the solution model for the initial question is extended to cover the first part of this one, extending it farther (see below) will be easier.
Given a matrix of signs B of size MxK (basically B[i,j] is from the set {<,>,<=,>=}), find the priority function V for which:
Sum(for all j in range [1,M]) {Count(i)}->EXTREMUM | V{i} B[j,1] V{i+1} B[j,2] ... B[j,K] V{i+K}
As an example, find the priority function V, for which the number of i, satisfying V{i}<V{i+1}<V{i+2} or V{i}>V{i+1}>V{i+2}, is minimum.
My intuition is that all variations on this problem will prove to be NP-hard. So I'd begin looking for heuristics that produce reasonable answers. This may involve some trial and error.
A simplistic approach is to write down a possible permutation. And then try possible swaps until you've arrived at a local minimum. Try several times, and pick the best answer.
Simulated annealing provides a more sophisticated version of this approach, see http://en.wikipedia.org/wiki/Simulated_annealing for a description. It may take some experimentation to find a set of parameters that seems to converge relatively well.
Another idea is to look for a genetic algorithm. Based on a quick Google search it looks like the standard way to do this is to try to turn an NP-complete problem into a SAT problem, and then use a genetic algorithm on that problem. This approach would require turning this into a SAT problem in some reasonable way. Unfortunately it is not obvious to me how one would go about doing this reduction. Indeed in the first version that you had, your problem was closely connected to a classic NP-hard problem. The fact that it is labeled NP-hard rather than NP-complete is evidence that people haven't found a good way to transform it into a SAT problem. So if it isn't obvious how to turn the simple version into a SAT problem, then you are unlikely to convert the hard problem either.
But you could still try some variation on genetic algorithms. Mutation is pretty simple, just swap some elements around. One way to combine elements would be to take 3 permutations and use quicksort to find the combination as follows: take a random pivot, and then use "majority wins" to bucket elements into bigger and smaller. Sort each half in the same way.
I'm sorry that I can't just give you an approach and say, "This should work." You've got what looks like an open-ended research project, and the best I can do is give you some ideas about things you can try that might work reasonably well.

Is this combinatorial optimization problem NP-hard?

I working on a combinatorial optimization problem that I suspect is NP-hard, and a genetic algorithm has been working well with our dataset. We're a research group and plan to publish our results in our field (not in math or CS), and I'd like to explore the NP-hard question before sending the manuscript out for review.
There are two main questions:
1) I'd like to know whether this particular optimization problem has been studied. I've heavily searched the lit but haven't seen anything exactly the same.
2) If the problem hasn't been studied, I might take a crack at doing a reducibility proof, and would like some pointers to good NP-complete candidates for the reduction.
The problem can be described in two ways, as a subsequence variant, and as a bipartite graph problem.
In the subsequence flavor, I want to find a "relaxed" subsequence that allows permutations, and optimize to minimize the permutation count. For example: (. = any other char)
Query: abc, Target: ..b.a.b.c., Result: abc (normal subsequence)
Query: abc, Target: ..b.a.c.a., Result: bac (subsequence with one permutation)
The bipartite formulation is a matching problem or linear assignment problem, with the graph partitioned into query character nodes and target character nodes. The edges connect the query characters to the target characters, such that there is exactly one edge from each query char to a target char. The objective function is to minimize the number of edge crossings (also called "crossing number" in the lit). This is similar to bipartite graph layout algorithms that reorder node placement to minimize edge crossings, but my problem requires the that both node orders stay fixed.
Any thoughts from the experts on questions 1 or 2?
Thanks in advance!
Just some idea: Does it somehow equivalent to finding the minimal number of swap needed to sort an array (MIN-SBR)? If yes, this is NP-Hard.
(btw, are you working on something similar to this?)
I don't think this is NP-hard. See work by Pevzner and Hannehali. A paper that comes to mind is titled ``From Cabbage to Turnip''. The idea is to find the minimum number of inversions to go from one string to another. They have a polytime algorithm for this.
The problem with "word problem" should be harder, right? – J-16 SDiZ 14
Yes, having multiple occurrences of the char in the target seems to make my problem harder than MIN-SBR, so from that angle my problem would be at least as hard as NP-complete. On the other hand, I'm not yet clear on how their central notion of block reversals would affect my claim of NP-completeness.
I sure would be nice to know whether my optimization can be solved in polynomial time. Put another way, it sure would be embarrassing if a reviewer came back with five lines of pseudocode that finds the global maximum in O(n)..
Would, Query: abc Target: ..c.b.a.a Result: cba, be three permutations (as per your use of the term) then? If so, then maybe you mean transpositions rather than permutations. A transposition is the swapping of two adjacent characters.
Good question. We're interested in a mapping from Query -> Target that has as few crossings as possible. This is very much the motivation for mentioning the bipartite edge crossings in the original post. Alternatively, you can think of maximizing a rank statistic, like Spearman's Rho, over the mapping.
Also, out of curiousity, how many unique characters are there in the query/target? – Justin Peel 18
Typical query: 100, typical target: 1000. Combinatorially, it's a huge solution space.

Resources