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 *

154 related articles for article (PubMed ID: 36985812)

  • 1. A Buckycatcher in Solution-A Computational Perspective.
    Menezes F; Popowicz GM
    Molecules; 2023 Mar; 28(6):. PubMed ID: 36985812
    [TBL] [Abstract][Full Text] [Related]  

  • 2. How to Catch the Ball: Fullerene Binding to the Corannulene Pincer.
    Menezes F; Popowicz GM
    Molecules; 2022 Jun; 27(12):. PubMed ID: 35744963
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Solution-State Hydrostatic Pressure Chemistry: Application to Molecular, Supramolecular, Polymer, and Biological Systems.
    Mizuno H; Fukuhara G
    Acc Chem Res; 2022 Jun; 55(12):1748-1762. PubMed ID: 35657708
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Determination of the enthalpy of solute-solvent interaction from the enthalpy of solution: aqueous solutions of erythritol and L-threitol.
    Lopes Jesus AJ; Tomé LI; Eusébio ME; Redinha JS
    J Phys Chem B; 2006 May; 110(18):9280-5. PubMed ID: 16671745
    [TBL] [Abstract][Full Text] [Related]  

  • 5. An unsolvated buckycatcher and its first dianion.
    Zabula AV; Sevryugina YV; Spisak SN; Kobryn L; Sygula R; Sygula A; Petrukhina MA
    Chem Commun (Camb); 2014 Mar; 50(20):2657-9. PubMed ID: 24473464
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Intermolecular interaction-controlled tuning of the two-photon absorption of fullerene bound in a buckycatcher.
    Chakrabarti S; Ruud K
    J Phys Chem A; 2009 May; 113(19):5485-8. PubMed ID: 19419222
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Accuracy comparison of several common implicit solvent models and their implementations in the context of protein-ligand binding.
    Katkova EV; Onufriev AV; Aguilar B; Sulimov VB
    J Mol Graph Model; 2017 Mar; 72():70-80. PubMed ID: 28064081
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Characterization of conformational equilibria through Hamiltonian and temperature replica-exchange simulations: assessing entropic and environmental effects.
    Faraldo-Gómez JD; Roux B
    J Comput Chem; 2007 Jul; 28(10):1634-47. PubMed ID: 17342721
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Theoretical in-Solution Conformational/Tautomeric Analyses for Chain Systems with Conjugated Double Bonds Involving Nitrogen(s).
    Nagy PI
    Int J Mol Sci; 2015 May; 16(5):10767-96. PubMed ID: 25984602
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Enthalpy-Entropy Interplay in π-Stacking Interaction of Benzene Dimer in Water.
    Lee H; Dehez F; Chipot C; Lim HK; Kim H
    J Chem Theory Comput; 2019 Mar; 15(3):1538-1545. PubMed ID: 30721623
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Chemical Equilibrium of Zinc Acetate Complexes in Ethanol Solution. A Theoretical Description through Thermodynamic Cycles.
    Reyna-Luna J; Flores R; Gómez-Balderas R; Franco-Pérez M
    J Phys Chem B; 2020 Apr; 124(16):3355-3370. PubMed ID: 32216349
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Anion Complexes with Tetrazine-Based Ligands: Formation of Strong Anion-π Interactions in Solution and in the Solid State.
    Savastano M; Bazzicalupi C; Giorgi C; García-Gallarín C; López de la Torre MD; Pichierri F; Bianchi A; Melguizo M
    Inorg Chem; 2016 Aug; 55(16):8013-24. PubMed ID: 27454810
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Conformational Preadjustment in Aqueous Claisen Rearrangement Revealed by SITS-QM/MM MD Simulations.
    Zhang J; Yang YI; Yang L; Gao YQ
    J Phys Chem B; 2015 Apr; 119(17):5518-30. PubMed ID: 25849201
    [TBL] [Abstract][Full Text] [Related]  

  • 14. ReSCoSS: a flexible quantum chemistry workflow identifying relevant solution conformers of drug-like molecules.
    Udvarhelyi A; Rodde S; Wilcken R
    J Comput Aided Mol Des; 2021 Apr; 35(4):399-415. PubMed ID: 32803515
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Inclusion complexes of buckycatcher with C(60) and C(70).
    Mück-Lichtenfeld C; Grimme S; Kobryn L; Sygula A
    Phys Chem Chem Phys; 2010 Jul; 12(26):7091-7. PubMed ID: 20517563
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Conformational energy penalties of protein-bound ligands.
    Boström J; Norrby PO; Liljefors T
    J Comput Aided Mol Des; 1998 Jul; 12(4):383-96. PubMed ID: 9777496
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Towards understanding solvation effects on the conformational entropy of non-rigid molecules.
    Gorges J; Grimme S; Hansen A; Pracht P
    Phys Chem Chem Phys; 2022 May; 24(20):12249-12259. PubMed ID: 35543018
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Quantum Chemical Calculations of Monomer-Dimer Equilibria of Aromatic C-Nitroso Compounds.
    Varga K; Biljan I; Tomišić V; Mihalić Z; Vančik H
    J Phys Chem A; 2018 Mar; 122(9):2542-2549. PubMed ID: 29381362
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Theoretical studies of the tautomeric equilibria for five-member N-heterocycles in the gas phase and in solution.
    Nagy PI; Tejada FR; Messer WS
    J Phys Chem B; 2005 Dec; 109(47):22588-602. PubMed ID: 16853941
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Thermodynamics of host-guest interactions between fullerenes and a buckycatcher.
    Le VH; Yanney M; McGuire M; Sygula A; Lewis EA
    J Phys Chem B; 2014 Oct; 118(41):11956-64. PubMed ID: 25248285
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 8.