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 *

135 related articles for article (PubMed ID: 27760289)

  • 1. Prediction of pK
    Giard A; Filhol JS; Jolibois F; Cavelier F; Berthomieu D
    J Chem Theory Comput; 2016 Nov; 12(11):5493-5500. PubMed ID: 27760289
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Influence of Solvent Representation on Nuclear Shielding Calculations of Protonation States of Small Biological Molecules.
    Roggatz CC; Lorch M; Benoit DM
    J Chem Theory Comput; 2018 May; 14(5):2684-2695. PubMed ID: 29566332
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Formation of metal-nicotianamine complexes as affected by pH, ligand exchange with citrate and metal exchange. A study by electrospray ionization time-of-flight mass spectrometry.
    Rellán-Alvarez R; Abadía J; Alvarez-Fernández A
    Rapid Commun Mass Spectrom; 2008 May; 22(10):1553-62. PubMed ID: 18421700
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Investigation of the acid-base and electromigration properties of 5-azacytosine derivatives using capillary electrophoresis and density functional theory calculations.
    Geffertová D; Ali ST; Šolínová V; Krečmerová M; Holý A; Havlas Z; Kašička V
    J Chromatogr A; 2017 Jan; 1479():185-193. PubMed ID: 27919519
    [TBL] [Abstract][Full Text] [Related]  

  • 5. pK
    Işık M; Levorse D; Rustenburg AS; Ndukwe IE; Wang H; Wang X; Reibarkh M; Martin GE; Makarov AA; Mobley DL; Rhodes T; Chodera JD
    J Comput Aided Mol Des; 2018 Oct; 32(10):1117-1138. PubMed ID: 30406372
    [TBL] [Abstract][Full Text] [Related]  

  • 6. High accuracy quantum-chemistry-based calculation and blind prediction of macroscopic pKa values in the context of the SAMPL6 challenge.
    Pracht P; Wilcken R; Udvarhelyi A; Rodde S; Grimme S
    J Comput Aided Mol Des; 2018 Oct; 32(10):1139-1149. PubMed ID: 30141103
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Prediction of pK
    Jensen JH; Swain CJ; Olsen L
    J Phys Chem A; 2017 Jan; 121(3):699-707. PubMed ID: 28054775
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Efficient Quantum-Chemical Calculations of Acid Dissociation Constants from Free-Energy Relationships.
    Pracht P; Grimme S
    J Phys Chem A; 2021 Jul; 125(25):5681-5692. PubMed ID: 34142841
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Accurate pKa calculation of the conjugate acids of alkanolamines, alkaloids and nucleotide bases by quantum chemical methods.
    Gangarapu S; Marcelis AT; Zuilhof H
    Chemphyschem; 2013 Apr; 14(5):990-5. PubMed ID: 23436741
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Absolute and relative pK
    Zeng Q; Jones MR; Brooks BR
    J Comput Aided Mol Des; 2018 Oct; 32(10):1179-1189. PubMed ID: 30128926
    [TBL] [Abstract][Full Text] [Related]  

  • 11. 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; 119(37):12249-55. PubMed ID: 26331783
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Multiconformation, Density Functional Theory-Based pK
    Bochevarov AD; Watson MA; Greenwood JR; Philipp DM
    J Chem Theory Comput; 2016 Dec; 12(12):6001-6019. PubMed ID: 27951674
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Isodesmic reaction for accurate theoretical pKa calculations of amino acids and peptides.
    Sastre S; Casasnovas R; Muñoz F; Frau J
    Phys Chem Chem Phys; 2016 Apr; 18(16):11202-12. PubMed ID: 27052591
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Revisiting the metal-binding chemistry of nicotianamine and 2'-deoxymugineic acid. Implications for iron nutrition in strategy II plants.
    Reichman SM; Parker DR
    Plant Physiol; 2002 Aug; 129(4):1435-8. PubMed ID: 12177457
    [No Abstract]   [Full Text] [Related]  

  • 15. Toward the accurate calculation of pKa values in water and acetonitrile.
    Muckerman JT; Skone JH; Ning M; Wasada-Tsutsui Y
    Biochim Biophys Acta; 2013; 1827(8-9):882-91. PubMed ID: 23567870
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Prediction Models on p
    Xu T; Chen J; Chen X; Xie H; Wang Z; Xia D; Tang W; Xie HB
    Environ Sci Technol; 2021 May; 55(9):6022-6031. PubMed ID: 33565873
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Rationalization of the pKa values of alcohols and thiols using atomic charge descriptors and its application to the prediction of amino acid pKa's.
    Ugur I; Marion A; Parant S; Jensen JH; Monard G
    J Chem Inf Model; 2014 Aug; 54(8):2200-13. PubMed ID: 25089727
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Nicotianamine and histidine/proline are, respectively, the most important copper chelators in xylem sap of Brassica carinata under conditions of copper deficiency and excess.
    Irtelli B; Petrucci WA; Navari-Izzo F
    J Exp Bot; 2009; 60(1):269-77. PubMed ID: 19033552
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Assessing the protonation state of drug molecules: the case of aztreonam.
    Díaz N; Sordo TL; Suárez D; Méndez R; Villacorta JM; Simón L; Rico M; Jiménez MA
    J Med Chem; 2006 Jun; 49(11):3235-43. PubMed ID: 16722641
    [TBL] [Abstract][Full Text] [Related]  

  • 20. The binding of aluminum to mugineic acid and related compounds as studied by potentiometric titration.
    Yoshimura E; Kohdr H; Mori S; Hider RC
    Biometals; 2011 Aug; 24(4):723-7. PubMed ID: 21350950
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.