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151 related items for PubMed ID: 30243274

  • 1. Insulin dimer dissociation in aqueous solution: A computational study of free energy landscape and evolving microscopic structure along the reaction pathway.
    Banerjee P, Mondal S, Bagchi B.
    J Chem Phys; 2018 Sep 21; 149(11):114902. PubMed ID: 30243274
    [Abstract] [Full Text] [Related]

  • 2. Dynamical control by water at a molecular level in protein dimer association and dissociation.
    Banerjee P, Bagchi B.
    Proc Natl Acad Sci U S A; 2020 Feb 04; 117(5):2302-2308. PubMed ID: 31969453
    [Abstract] [Full Text] [Related]

  • 3. Rate of Insulin Dimer Dissociation: Interplay between Memory Effects and Higher Dimensionality.
    Acharya S, Mondal S, Mukherjee S, Bagchi B.
    J Phys Chem B; 2021 Sep 02; 125(34):9678-9691. PubMed ID: 34406771
    [Abstract] [Full Text] [Related]

  • 4. Insulin aspart dimer dissociation in water.
    Chaudhary Y, Bhimalapuram P.
    J Chem Phys; 2022 Mar 14; 156(10):105106. PubMed ID: 35291774
    [Abstract] [Full Text] [Related]

  • 5. Effect of ethanol on insulin dimer dissociation.
    Banerjee P, Mondal S, Bagchi B.
    J Chem Phys; 2019 Feb 28; 150(8):084902. PubMed ID: 30823756
    [Abstract] [Full Text] [Related]

  • 6. A comparison of the dynamic behavior of monomeric and dimeric insulin shows structural rearrangements in the active monomer.
    Zoete V, Meuwly M, Karplus M.
    J Mol Biol; 2004 Sep 17; 342(3):913-29. PubMed ID: 15342246
    [Abstract] [Full Text] [Related]

  • 7. Distinct role of hydration water in protein misfolding and aggregation revealed by fluctuating thermodynamics analysis.
    Chong SH, Ham S.
    Acc Chem Res; 2015 Apr 21; 48(4):956-65. PubMed ID: 25844814
    [Abstract] [Full Text] [Related]

  • 8. Force-induced insulin dimer dissociation: a molecular dynamics study.
    Kim T, Rhee A, Yip CM.
    J Am Chem Soc; 2006 Apr 26; 128(16):5330-1. PubMed ID: 16620090
    [Abstract] [Full Text] [Related]

  • 9. Toward an improved understanding of the dissociation mechanism of gas phase protein complexes.
    Wanasundara SN, Thachuk M.
    J Phys Chem B; 2010 Sep 09; 114(35):11646-53. PubMed ID: 20704302
    [Abstract] [Full Text] [Related]

  • 10. Sensitivity of water dynamics to biologically significant surfaces of monomeric insulin: role of topology and electrostatic interactions.
    Bagchi K, Roy S.
    J Phys Chem B; 2014 Apr 10; 118(14):3805-13. PubMed ID: 24641444
    [Abstract] [Full Text] [Related]

  • 11. Unfolding of Dynamical Events in the Early Stage of Insulin Dimer Dissociation.
    Mondal S, Mukherjee S, Acharya S, Bagchi B.
    J Phys Chem B; 2021 Jul 29; 125(29):7958-7966. PubMed ID: 34260242
    [Abstract] [Full Text] [Related]

  • 12. The Role of Water in the Stability of Wild-type and Mutant Insulin Dimers.
    Raghunathan S, El Hage K, Desmond JL, Zhang L, Meuwly M.
    J Phys Chem B; 2018 Jul 19; 122(28):7038-7048. PubMed ID: 29916244
    [Abstract] [Full Text] [Related]

  • 13. Equilibrium Ensembles for Insulin Folding from Bias-Exchange Metadynamics.
    Singh R, Bansal R, Rathore AS, Goel G.
    Biophys J; 2017 Apr 25; 112(8):1571-1585. PubMed ID: 28445749
    [Abstract] [Full Text] [Related]

  • 14. Structural Stability of Insulin Oligomers and Protein Association-Dissociation Processes: Free Energy Landscape and Universal Role of Water.
    Mukherjee S, Acharya S, Mondal S, Banerjee P, Bagchi B.
    J Phys Chem B; 2021 Nov 04; 125(43):11793-11811. PubMed ID: 34674526
    [Abstract] [Full Text] [Related]

  • 15. Structural and thermodynamics characters of isolated α-syn12 peptide: long-time temperature replica-exchange molecular dynamics in aqueous solution.
    Cao Z, Liu L, Wu P, Wang J.
    Acta Biochim Biophys Sin (Shanghai); 2011 Mar 04; 43(3):172-80. PubMed ID: 21289072
    [Abstract] [Full Text] [Related]

  • 16. Free energy landscape of A-DNA to B-DNA conversion in aqueous solution.
    Banavali NK, Roux B.
    J Am Chem Soc; 2005 May 11; 127(18):6866-76. PubMed ID: 15869310
    [Abstract] [Full Text] [Related]

  • 17. Free energy calculations of gramicidin dimer dissociation.
    Wanasundara SN, Krishnamurthy V, Chung SH.
    J Phys Chem B; 2011 Nov 24; 115(46):13765-70. PubMed ID: 21988458
    [Abstract] [Full Text] [Related]

  • 18. Studying Protein-Protein Binding through T-Jump Induced Dissociation: Transient 2D IR Spectroscopy of Insulin Dimer.
    Zhang XX, Jones KC, Fitzpatrick A, Peng CS, Feng CJ, Baiz CR, Tokmakoff A.
    J Phys Chem B; 2016 Jun 16; 120(23):5134-45. PubMed ID: 27203447
    [Abstract] [Full Text] [Related]

  • 19. Ab Initio Molecular Dynamics Simulations of Amino Acids in Aqueous Solutions: Estimating pKa Values from Metadynamics Sampling.
    Tummanapelli AK, Vasudevan S.
    J Phys Chem B; 2015 Sep 17; 119(37):12249-55. PubMed ID: 26331783
    [Abstract] [Full Text] [Related]

  • 20. Evaluation of protein-protein docking model structures using all-atom molecular dynamics simulations combined with the solution theory in the energy representation.
    Takemura K, Guo H, Sakuraba S, Matubayasi N, Kitao A.
    J Chem Phys; 2012 Dec 07; 137(21):215105. PubMed ID: 23231264
    [Abstract] [Full Text] [Related]

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