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arxiv: 1910.07614 · v3 · pith:ZOVHJX5Lnew · submitted 2019-10-16 · 🧬 q-bio.BM · cond-mat.soft· physics.bio-ph

Sharp DNA denaturation in a helicoidal mesoscopic model

classification 🧬 q-bio.BM cond-mat.softphysics.bio-ph
keywords modelapproximationscalculationshamiltonianmeltingmolecularsharptwist
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The Peyrard-Bishop DNA model describes the molecular interactions with simple potentials which allow efficient calculations of melting temperatures. However, it is based on a Hamiltonian that does not consider the helical twist or any other relevant molecular dimensions. Here, we start from a more realistic 3D model and work out several approximations to arrive at a new non-linear 1D Hamiltonian with a twist angle dependence. Our approximations were numerically compared to full 3D calculations, and established its validity in the regime of small angles. For long DNA sequences we obtain sharp, first-order-like melting, transitions.

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