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LNCS 2950 - Aspects of Molecular Computing (Frontmatter Pages)

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An Algorithm for Testing Structure Freeness <strong>of</strong> Biomolecular Sequences 271<br />

ii +1<br />

···•=⇒•=⇒•··· •<br />

| ⇓<br />

···•⇐=•⇐=•··· •<br />

jj − 1<br />

(a) Hairpin<br />

ii +1 p − 1p<br />

···•=⇒•=⇒•··· •=⇒•=⇒•···<br />

| |<br />

···•⇐=•⇐=•··· •⇐=•⇐=•···<br />

jj − 1 q +1q<br />

1 i − 1i<br />

•=⇒···=⇒•=⇒•···<br />

|<br />

•⇐=···⇐=•⇐=•···<br />

N j +1j<br />

(b) Free End<br />

(c) Internal Loop<br />

(Bulge Loop in case <strong>of</strong> i +1=p or j = q +1)<br />

(Stacked Pair in case <strong>of</strong> i +1=p and j = q +1)<br />

Fig. 1. Basic Secondary Structures<br />

β,γ ∈ S. Then, (i, j) is said to have configuration (β,k,γ,l) inα(T )iftheith<br />

and jth bases <strong>of</strong> α correspond to the kth base <strong>of</strong> the segment β and the lth base<br />

<strong>of</strong> the segment γ, respectively. More formally, (i, j) issaidtohave configuration<br />

(β,k,γ,l) in α(T )ifthereexistx, y, z, w ∈ S∗ such that α = xβy = zγw,<br />

|x| bpm, is defined as a sequence cf(bp1), ..., cf(bpm). For two structured<br />

strings α1(T1) andα2(T2), we write α1(T1) ≡ α2(T2)ifcf(α1(T1)) = cf(α2(T2)).<br />

A structured string α(T )issaidtobeE-minimal if for any α ′ (T ′ )such<br />

that α(T ) ≡ α ′ (T ′ ), E(α(T )) ≤ E(α ′ (T ′ )) holds. The existence <strong>of</strong> such an Eminimal<br />

structured string is not clear at this point. But, we can show that for<br />

any configuration C, there always exists an E-minimal structured string α(T )<br />

such that cf(α(T )) = C, which will be implicitly proved in the pro<strong>of</strong> <strong>of</strong> (2)→(1)<br />

in Theorem 2.<br />

A2-cyclec with base pairs bp1,bp2 (bp2 < bp1) inα(T )issaidtohave<br />

boundary configuration (v1,v2) ifcf(bpi) =vi (i =1, 2). A 1-cycle or a free end<br />

structure c with a base pair bp in α(T ) is said to have the boundary configuration<br />

v if cf(bp) =v.

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