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We report 10 successfully folding events of trpzip2 by molecular dynamics simulation. It is found that the trizip2 can fold into its native state through different zipper pathways, depending on the ways of forming hydrophobic core. We also…

Biomolecules · Quantitative Biology 2007-05-23 Changjun Chen , Yi Xiao

We study minimum-energy pathways (MEPs) between the branches of metastable helical structures in chiral nematic liquid crystals (CNLCs)subjected to the electric field applied across the cell. By performing stability analysis we have found…

Soft Condensed Matter · Physics 2020-11-05 Semen S. Tenishchev , Ivan M. Tambovtcev , Alexei D. Kiselev , Valery M. Uzdin

RNA polymerase (RNAP) is an enzyme that synthesizes a messenger RNA (mRNA) strand which is complementary to a single-stranded DNA template. From the perspective of physicists, an RNAP is a molecular motor that utilizes chemical energy input…

Biological Physics · Physics 2007-08-08 Tripti Tripathi , Debashish Chowdhury

We study a class of micromanipulation experiments, exemplified by the pulling apart of the two strands of double-stranded DNA (dsDNA). When the pulling force is increased to a critical value, an ``unzipping'' transition occurs. For random…

Soft Condensed Matter · Physics 2009-10-31 David K. Lubensky , David R. Nelson

We consider two complementary polymer strands of length $L$ attached by a common end monomer. The two strands bind through complementary monomers and at low temperatures form a double stranded conformation (zipping), while at high…

Statistical Mechanics · Physics 2015-03-19 Jean-Charles Walter , Alessandro Ferrantini , Enrico Carlon , Carlo Vanderzande

We develope a theoretical framework, based on exclusion process, that is motivated by a biological phenomenon called transcript slippage (TS). In this model a discrete lattice represents a DNA strand while each of the particles that hop on…

Statistical Mechanics · Physics 2019-05-22 Soumendu Ghosh , Annwesha Dutta , Shubhadeep Patra , Jun Sato , Katsuhiro Nishinari , Debashish Chowdhury

We unzip DNA molecules using optical tweezers and determine the sizes of the cooperatively unzipping and zipping regions separating consecutive metastable intermediates along the unzipping pathway. Sizes are found to be distributed…

Biological Physics · Physics 2016-11-25 J. M. Huguet , N. Forns , F. Ritort

We investigate the quasi-static magnetic behavior of ensembles of non-interacting ferromagnetic nanoparticles consisting of MnP nanoclusters embedded in GaP(001) epilayers grown at 600, 650 and 700{\deg}C. We use a phenomenological model,…

Materials Science · Physics 2016-03-23 Christian Lacroix , Samuel Lambert-Milot , Patrick Desjardins , Remo A. Masut , David Menard

Non-coding RNA sequences play a great role in controlling a number of cellular functions, thus raising the need to understand their complex conformational dynamics in quantitative detail. In this perspective, we first show that single…

Biomolecules · Quantitative Biology 2012-11-29 Jong-Chin Lin , Changbong Hyeon , D. Thirumalai

The unzipping of a double stranded DNA whose ends are subjected to a time dependent periodic force with frequency $\omega$ and amplitude $G$ is studied using Monte Carlo simulations. We obtain the dynamical order parameter, $Q$, defined as…

Soft Condensed Matter · Physics 2019-06-17 M. Suman Kalyan , Rajeev Kapri

Experimental variables of optical tweezers instrumentation that affect RNA folding/unfolding kinetics were investigated. A model RNA hairpin, P5ab, was attached to two micron-sized beads through hybrid RNA/DNA handles; one bead was trapped…

Biological Physics · Physics 2009-11-13 J. -D. Wen , M. Manosas , P. T. X. Li , S. B. Smith , C. Bustamante , F. Ritort , I. Tinoco

Because of the potential link between -1 programmed ribosomal frameshifting and response of a pseudoknot (PK) RNA to force, a number of single molecule pulling experiments have been performed on PKs to decipher the mechanism of programmed…

Biomolecules · Quantitative Biology 2016-06-22 Naoto Hori , Natalia A. Denesyuk , D. Thirumalai

We studied the unzipping kinetics of single molecules of double-stranded DNA by pulling one of their two strands through a narrow protein pore. PCR analysis yielded the first direct proof of DNA unzipping in such a system. The time to unzip…

Soft Condensed Matter · Physics 2009-11-07 Alexis F. Sauer-Budge , Jacqueline A. Nyamwanda , David K. Lubensky , Daniel Branton

We consider a simple model for the unfolding of RNA tertiary structure under dynamic loading. The opening of such a structure is regarded as a two step process, each corresponding to the overcoming of a single energy barrier. The resulting…

Biomolecules · Quantitative Biology 2009-11-10 Alberto Imparato , Luca Peliti

Irreversible thermodynamics of single-molecule experiments subject to external constraining forces of a mechanical nature is presented. Extending Onsager's formalism to the non-linear case of systems under non-equilibrium external…

Biological Physics · Physics 2016-10-31 I. Santamaria-Holek , N. J. Lopez-Alamilla , M. Hidalgo-Soria , A. Perez-Madrid

Atomically detailed simulations of RNA folding have proven very challenging in view of the difficulties of developing realistic force fields and the intrinsic computational complexity of sampling rare conformational transitions. To tackle…

Soft Condensed Matter · Physics 2022-05-26 Gianmarco Lazzeri , Cristian Micheletti , Samuela Pasquali , Pietro Faccioli

We use kinetic particle-in-cell and magnetohydrodynamic simulations supported by an observational dataset to investigate magnetic reconnection in clusters of null points in space plasma. The magnetic configuration under investigation is…

Earth and Planetary Astrophysics · Physics 2015-09-29 Vyacheslav Olshevsky , Andrey Divin , Elin Eriksson , Stefano Markidis , Giovanni Lapenta

RNA's diversity of structures and functions impacts all life forms since primordia. We use calorimetric force spectroscopy to investigate RNA folding landscapes in previously unexplored low-temperature conditions. We find that Watson-Crick…

Biomolecules · Quantitative Biology 2024-04-30 Paolo Rissone , Aurelien Severino , Isabel Pastor , Felix Ritort

The unzipping transition under the influence of external force of a dsDNA molecule has been studied using the Peyrard-Bishop Hamiltonian. The critical force $F_c(T)$ is found to depend on the potential parameters $k$, represents the…

Soft Condensed Matter · Physics 2007-05-23 Navin Singh , Yashwant Singh

We present an extensive theoretical investigation of the mechanical unzipping of double-stranded DNA under the influence of an applied force. In the limit of long polymers, there is a thermodynamic unzipping transition at a critical force…

Soft Condensed Matter · Physics 2009-11-07 David K. Lubensky , David R. Nelson