These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

116 related articles for article (PubMed ID: 38984959)

  • 1. Quantum rates in dissipative systems with spatially varying friction.
    Bridge O; Lazzaroni P; Martinazzo R; Rossi M; Althorpe SC; Litman Y
    J Chem Phys; 2024 Jul; 161(2):. PubMed ID: 38984959
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Dissipative tunneling rates through the incorporation of first-principles electronic friction in instanton rate theory. II. Benchmarks and applications.
    Litman Y; Pós ES; Box CL; Martinazzo R; Maurer RJ; Rossi M
    J Chem Phys; 2022 May; 156(19):194107. PubMed ID: 35597654
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Dissipative tunneling rates through the incorporation of first-principles electronic friction in instanton rate theory. I. Theory.
    Litman Y; Pós ES; Box CL; Martinazzo R; Maurer RJ; Rossi M
    J Chem Phys; 2022 May; 156(19):194106. PubMed ID: 35597633
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Ring-polymer molecular dynamics rate-theory in the deep-tunneling regime: Connection with semiclassical instanton theory.
    Richardson JO; Althorpe SC
    J Chem Phys; 2009 Dec; 131(21):214106. PubMed ID: 19968336
    [TBL] [Abstract][Full Text] [Related]  

  • 5. How to remove the spurious resonances from ring polymer molecular dynamics.
    Rossi M; Ceriotti M; Manolopoulos DE
    J Chem Phys; 2014 Jun; 140(23):234116. PubMed ID: 24952532
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Direct simulation of electron transfer using ring polymer molecular dynamics: comparison with semiclassical instanton theory and exact quantum methods.
    Menzeleev AR; Ananth N; Miller TF
    J Chem Phys; 2011 Aug; 135(7):074106. PubMed ID: 21861555
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Bimolecular reaction rates from ring polymer molecular dynamics: application to H + CH4 → H2 + CH3.
    Suleimanov YV; Collepardo-Guevara R; Manolopoulos DE
    J Chem Phys; 2011 Jan; 134(4):044131. PubMed ID: 21280711
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Which Is Better at Predicting Quantum-Tunneling Rates: Quantum Transition-State Theory or Free-Energy Instanton Theory?
    Zhang Y; Stecher T; Cvitaš MT; Althorpe SC
    J Phys Chem Lett; 2014 Nov; 5(22):3976-80. PubMed ID: 26276480
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Microcanonical rates from ring-polymer molecular dynamics: Direct-shooting, stationary-phase, and maximum-entropy approaches.
    Tao X; Shushkov P; Miller TF
    J Chem Phys; 2020 Mar; 152(12):124117. PubMed ID: 32241127
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Kinetically-constrained ring-polymer molecular dynamics for non-adiabatic chemistries involving solvent and donor-acceptor dynamical effects.
    Kretchmer JS; Miller Iii TF
    Faraday Discuss; 2016 Dec; 195():191-214. PubMed ID: 27722690
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Investigating Tunneling-Controlled Chemical Reactions through Ab Initio Ring Polymer Molecular Dynamics.
    Li X; Huo P
    J Phys Chem Lett; 2021 Jul; 12(28):6714-6721. PubMed ID: 34261316
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Elucidating Heavy-Atom-Tunneling Kinetics in the Cope Rearrangement of Semibullvalene.
    Angiolari F; Mandelli G; Huppert S; Aieta C; Spezia R
    Chemistry; 2024 Oct; 30(60):e202401000. PubMed ID: 38924666
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Electronic friction near metal surface: Incorporating nuclear quantum effect with ring polymer molecular dynamics.
    Bi RH; Dou W
    J Chem Phys; 2024 Feb; 160(7):. PubMed ID: 38380747
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Mixed quantum classical calculation of proton transfer reaction rates: from deep tunneling to over the barrier regimes.
    Xie W; Xu Y; Zhu L; Shi Q
    J Chem Phys; 2014 May; 140(17):174105. PubMed ID: 24811623
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Quantum information scrambling and chemical reactions.
    Zhang C; Kundu S; Makri N; Gruebele M; Wolynes PG
    Proc Natl Acad Sci U S A; 2024 Apr; 121(15):e2321668121. PubMed ID: 38557180
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Stress Test for Quantum Dynamics Approximations: Deep Tunneling in the Muonium Exchange Reaction D + HMu → DMu + H.
    Pérez de Tudela R; Suleimanov YV; Richardson JO; Sáez Rábanos V; Green WH; Aoiz FJ
    J Phys Chem Lett; 2014 Dec; 5(23):4219-24. PubMed ID: 26278957
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Ring Polymer Molecular Dynamics in Gas-Surface Reactions: Inclusion of Quantum Effects Made Simple.
    Liu Q; Zhang L; Li Y; Jiang B
    J Phys Chem Lett; 2019 Dec; 10(23):7475-7481. PubMed ID: 31738557
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Chemical Reaction Rates from Ring Polymer Molecular Dynamics: Zero Point Energy Conservation in Mu + H2 → MuH + H.
    Pérez de Tudela R; Aoiz FJ; Suleimanov YV; Manolopoulos DE
    J Phys Chem Lett; 2012 Feb; 3(4):493-7. PubMed ID: 26286053
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Competing quantum effects in the free energy profiles and diffusion rates of hydrogen and deuterium molecules through clathrate hydrates.
    Cendagorta JR; Powers A; Hele TJ; Marsalek O; Bačić Z; Tuckerman ME
    Phys Chem Chem Phys; 2016 Nov; 18(47):32169-32177. PubMed ID: 27849073
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Ring Polymer Molecular Dynamics Approach to Quantum Dissociative Chemisorption Rates.
    Zhang L; Zuo J; Suleimanov YV; Guo H
    J Phys Chem Lett; 2023 Aug; 14(31):7118-7125. PubMed ID: 37531595
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.