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 *

118 related articles for article (PubMed ID: 34928279)

  • 1. Effect of solvent motions on the dynamics of the Diels-Alder reaction.
    Zhang X; Lefebvre PL; Harvey JN
    Phys Chem Chem Phys; 2022 Jan; 24(2):1120-1130. PubMed ID: 34928279
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Validation of the direct-COSMO-RS solvent model for Diels-Alder reactions in aqueous solution.
    Theilacker K; Buhrke D; Kaupp M
    J Chem Theory Comput; 2015 Jan; 11(1):111-21. PubMed ID: 26574209
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Enhanced Sampling Simulation Reveals How Solvent Influences Chirogenesis of the Intra-Molecular Diels-Alder Reaction.
    Han X; Zhang J; Yang YI; Zhang Z; Yang L; Gao YQ
    J Chem Theory Comput; 2022 Jul; 18(7):4318-4326. PubMed ID: 35666128
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Enhanced Mobility during Diels-Alder Reaction: Results of Molecular Simulations.
    Reid KM; Leitner DM
    J Phys Chem Lett; 2022 Apr; 13(16):3763-3769. PubMed ID: 35446035
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Taking the plunge: chemical reaction dynamics in liquids.
    Orr-Ewing AJ
    Chem Soc Rev; 2017 Dec; 46(24):7597-7614. PubMed ID: 28681050
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Coupling between protein and reaction dynamics in enzymatic processes: application of Grote-Hynes Theory to catechol O-methyltransferase.
    Roca M; Moliner V; Tuñón I; Hynes JT
    J Am Chem Soc; 2006 May; 128(18):6186-93. PubMed ID: 16669689
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Application of Grote-Hynes theory to the reaction catalyzed by thymidylate synthase.
    Kanaan N; Roca M; Tuñón I; Martí S; Moliner V
    J Phys Chem B; 2010 Oct; 114(42):13593-600. PubMed ID: 20925368
    [TBL] [Abstract][Full Text] [Related]  

  • 8. DFT Study of Solvent Effects in Acid-Catalyzed Diels-Alder Cycloadditions of 2,5-Dimethylfuran and Maleic Anhydride.
    Salavati-fard T; Caratzoulas S; Doren DJ
    J Phys Chem A; 2015 Sep; 119(38):9834-43. PubMed ID: 26331220
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Effect of Lewis acid catalysts on Diels-Alder and hetero-Diels-Alder cycloadditions sharing a common transition state.
    Celebi-Olçüm N; Ess DH; Aviyente V; Houk KN
    J Org Chem; 2008 Oct; 73(19):7472-80. PubMed ID: 18781801
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Macromolecular crowding: chemistry and physics meet biology (Ascona, Switzerland, 10-14 June 2012).
    Foffi G; Pastore A; Piazza F; Temussi PA
    Phys Biol; 2013 Aug; 10(4):040301. PubMed ID: 23912807
    [TBL] [Abstract][Full Text] [Related]  

  • 11. QM/MM Protocol for Direct Molecular Dynamics of Chemical Reactions in Solution: The Water-Accelerated Diels-Alder Reaction.
    Yang Z; Doubleday C; Houk KN
    J Chem Theory Comput; 2015 Dec; 11(12):5606-12. PubMed ID: 26588803
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Visualization of fast energy flow and solvent caging in unimolecular dynamics.
    Rejto PA; Bindewald E; Chandler D
    Nature; 1995 May; 375(6527):129-31. PubMed ID: 7753167
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Influence of water and enzyme SpnF on the dynamics and energetics of the ambimodal [6+4]/[4+2] cycloaddition.
    Yang Z; Yang S; Yu P; Li Y; Doubleday C; Park J; Patel A; Jeon BS; Russell WK; Liu HW; Russell DH; Houk KN
    Proc Natl Acad Sci U S A; 2018 Jan; 115(5):E848-E855. PubMed ID: 29348209
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Role of dynamics in enzyme catalysis: substantial versus semantic controversies.
    Kohen A
    Acc Chem Res; 2015 Feb; 48(2):466-73. PubMed ID: 25539442
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Dynamics, transition states, and timing of bond formation in Diels-Alder reactions.
    Black K; Liu P; Xu L; Doubleday C; Houk KN
    Proc Natl Acad Sci U S A; 2012 Aug; 109(32):12860-5. PubMed ID: 22753502
    [TBL] [Abstract][Full Text] [Related]  

  • 16. A rationalization of the solvent effect on the Diels-Alder reaction in ionic liquids using multiparameter linear solvation energy relationships.
    Bini R; Chiappe C; Mestre VL; Pomelli CS; Welton T
    Org Biomol Chem; 2008 Jul; 6(14):2522-9. PubMed ID: 18600273
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Surprising Dynamics Phenomena in the Diels-Alder Reaction of C
    Hou YF; Zhang Q; Dral PO
    J Org Chem; 2024 Oct; 89(20):15041-15047. PubMed ID: 39358911
    [TBL] [Abstract][Full Text] [Related]  

  • 18. A free-energy perturbation method based on Monte Carlo simulations using quantum mechanical calculations (QM/MC/FEP method): application to highly solvent-dependent reactions.
    Hori K; Yamaguchi T; Uezu K; Sumimoto M
    J Comput Chem; 2011 Apr; 32(5):778-86. PubMed ID: 21341291
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Shape complementarity, binding-site dynamics, and transition state stabilization: a theoretical study of Diels-Alder catalysis by antibody 1E9.
    Chen J; Deng Q; Wang R; Houk K; Hilvert D
    Chembiochem; 2000 Nov; 1(4):255-61. PubMed ID: 11828417
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Metal-free, noncovalent catalysis of diels-alder reactions by neutral hydrogen bond donors in organic solvents and in water.
    Wittkopp A; Schreiner PR
    Chemistry; 2003 Jan; 9(2):407-14. PubMed ID: 12532289
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.