Parallel comparison of two DNAString objects with IUPAC ambiguities
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maltethodberg ▴ 180
@maltethodberg-9690
Last seen 4 days ago
Denmark

Is there a way to compare each letter of two DNAString objects of the same length while taking into account IUPAC nucleotide ambiguity codes?

For example:

# Example strings
x <- DNAString("ACTAGCTG")
y <- DNAString("ACYAGCBA")

# == only gives a single value
x == y

# DNAStringSets does not not use ambiguity codes
split(x) == split(y)

I would like following output: c(TRUE, TRUE, TRUE, TRUE, TRUE, TRUE, TRUE, FALSE)

The actual DNAString objects I'm looking at are up to millions of letters long.

Biostrings • 424 views
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Aidan ▴ 40
@3efa9cc7
Last seen 7 weeks ago
United States

I'm not sure if this is the best way to go about it, but I'd probably do something like the following:

compareStrings <- function(dna1, dna2){
  (as.raw(dna1) & as.raw(dna2))  > 0
}

compareStringsNoGaps <- function(dna1, dna2){
  ((as.raw(dna1) & as.raw(dna2)) & as.raw(15))  > 0
}

x <- DNAString("ATGCATGCATGC")
y <- DNAString("ATGGAYYCANNA")
compareStrings(x, y)
# [1]  TRUE  TRUE  TRUE FALSE  TRUE  TRUE FALSE  TRUE  TRUE  TRUE  TRUE FALSE

which(compareStrings(x,y))
# [1]  1  2  3  5  6  8  9 10 11


## your example
x <- DNAString("ACTAGCTG")
y <- DNAString("ACYAGCBA")
compareStrings(x,y)
# [1]  TRUE  TRUE  TRUE  TRUE  TRUE  TRUE  TRUE FALSE

## have to AND with 15 to prevent matching to gaps, if that's important
compareStrings(DNAString("ATGC.+-"),DNAString("NNNN.+-"))                                                                    
[1]  TRUE  TRUE  TRUE  TRUE TRUE TRUE TRUE

compareStringsNoGaps(DNAString("ATGC.+-"),DNAString("NNNN.+-"))                                                                    
[1]  TRUE  TRUE  TRUE  TRUE FALSE FALSE FALSE

That does require that you have enough space for a raw vector as long as the DNAString, but since you're looking for an output that's logical(length(x)), that shouldn't really be a problem.

The first function returns TRUE if the two characters match (obeying ambiguities). The second returns TRUE if the two characters match AND neither character is a gap character (+-.).

Edit: just wanted to give more detail on why this works.

DNAString objects store their values internally as bits, with A=0b0001, C=0b0010, G=0b0100, T=0b1000. Ambiguity codes are created by bitwise-ORs on the values (so M = (A OR C) = 0b0011). You can see all the values for these with xscodes(DNAString()) (though they're expressed in decimal).

Calling as.raw on a DNAString object will convert it to its raw bit representation. If you then AND the strings together, only bits in common will remain. For example, if one position has M and the other A, then M AND A = 0b0011 & 0b0001 = 0b0001 = A. That means that if they have any bits in common, they'll return a non-zero value, and otherwise it'll be zero.

There's a slight hiccup in that other ambiguities are stored in the higher bits. In addition to the first four bits, the fifth bit denotes -, the sixth +, and the seventh .. If it's important to return FALSE when both strings are the same value and in -+., then you have to remove the bits above the fourth bit, which is done with a bitwise AND with 15 = 0b1111.

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