Statistical mechanics articles within Scientific Reports

Featured

• Article
  24 March 2023 | Open Access

  Critical temperature shift modeling of confined fluids using pore-size-dependent energy parameter of potential function

  • Mohammad Humand
  •  & Mohammad Reza Khorsand Movaghar

• Article
  11 October 2022 | Open Access

  Frustrations of supported catalytic clusters under operando conditions predicted by a simple lattice model

  • Alexander Korobov

• Article
  10 August 2022 | Open Access

  Absolute binding free energy calculations improve enrichment of actives in virtual compound screening

  • Mudong Feng
  • , Germano Heinzelmann
  •  & Michael K. Gilson

• Article
  12 August 2020 | Open Access

  Insights on small molecule binding to the Hv1 proton channel from free energy calculations with molecular dynamics simulations

  • Victoria T. Lim
  • , Andrew D. Geragotelis
  •  & Douglas J. Tobias

• Article
  22 June 2020 | Open Access

  Cellular polyamines condense hyperphosphorylated Tau, triggering Alzheimer’s disease

  • Stefan M. Ivanov
  • , Mariyana Atanasova
  •  & Irini A. Doytchinova

• Article
  19 February 2020 | Open Access

  Dynamic vs static behaviour of a supported nanoparticle with reaction-induced catalytic sites in a lattice model

  • Alexander Korobov

• Article
  12 December 2019 | Open Access

  Elucidating the correlations between cancer initiation times and lifetime cancer risks

  • Hamid Teimouri
  • , Maria P. Kochugaeva
  •  & Anatoly B. Kolomeisky

• Article
  08 November 2019 | Open Access

  Stochastic and Heterogeneous Cancer Cell Migration: Experiment and Theory

  • Taejin Kwon
  • , Ok-Seon Kwon
  •  & Bong June Sung

• Article
  26 March 2019 | Open Access

  Theoretical analysis on thermodynamic stability of chignolin

  • Tomonari Sumi
  •  & Kenichiro Koga

• Article
  22 January 2019 | Open Access

  Non-universality of the dynamic exponent in two-dimensional random media

  • Hyun Woo Cho
  • , Arun Yethiraj
  •  & Bong June Sung

• Article
  31 August 2017 | Open Access

  Predicting the Ionic Product of Water

  • Eva Perlt
  • , Michael von Domaros
  •  & Frank Weinhold

• Article
  14 July 2017 | Open Access

  Electron-transfer chain in respiratory complex I

  • Daniel R. Martin
  •  & Dmitry V. Matyushov

• Article
  14 June 2016 | Open Access

  Energy Landscape Topography Reveals the Underlying Link Between Binding Specificity and Activity of Enzymes

  • Wen-Ting Chu
  •  & Jin Wang

• Article
  26 October 2015 | Open Access

  Chelating effect in short polymers for the design of bidentate binders of increased affinity and selectivity

  • Sara Fortuna
  • , Federico Fogolari
  •  & Giacinto Scoles

• Article
  22 January 2014 | Open Access

  A Highly Reversible Lithium Metal Anode

  • Min Sik Park
  • , Sang Bok Ma
  •  & Osamu Yamamoto