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 *

128 related articles for article (PubMed ID: 22423278)

  • 1. Computational evidence for intramolecular hydrogen bonding and nonbonding X···O interactions in 2'-haloflavonols.
    Fonseca TA; Freitas MP; Cormanich RA; Ramalho TC; Tormena CF; Rittner R
    Beilstein J Org Chem; 2012; 8():112-7. PubMed ID: 22423278
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Effect of the Intramolecular Hydrogen Bond on the Active Metabolite Analogs of Leflunomide for Blocking the Plasmodium falciparum Dihydroorotate Dehydrogenase Enzyme: QTAIM, NBO, and Docking Study.
    Heidarian R; Zahedi-Tabrizi M
    Curr Comput Aided Drug Des; 2021; 17(3):480-491. PubMed ID: 32459610
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Quantification of hydrogen bond energy based on equations using spectroscopic, structural, QTAIM-based, and NBO-based descriptors which calibrated by the molecular tailoring approach.
    Afonin AV; Rusinska-Roszak D
    J Mol Model; 2023 Dec; 30(1):18. PubMed ID: 38159168
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Hydrogen-bonding interactions in adrenaline-water complexes: DFT and QTAIM studies of structures, properties, and topologies.
    Wang H; Huang Z; Shen T; Guo L
    J Mol Model; 2012 Jul; 18(7):3113-23. PubMed ID: 22212733
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Energetic and geometrical evidence of nonbonding character of some intramolecular halogen···oxygen and other Y···Y interactions.
    Jabłoński M
    J Phys Chem A; 2012 Apr; 116(14):3753-64. PubMed ID: 22432471
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Intramolecular double proton transfer from 2-hydroxy-2-iminoacetic acid to 2-amino-2-oxoacetic acid.
    Bankiewicz B; Wojtulewski S; Grabowski SJ
    J Org Chem; 2010 Mar; 75(5):1419-26. PubMed ID: 20136101
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Three centered hydrogen bonds of the type C=O···H(N)···X-C in diphenyloxamide derivatives involving halogens and a rotating CF3 group: NMR, QTAIM, NCI and NBO studies.
    Lakshmipriya A; Rama Chaudhari S; Shahi A; Arunan E; Suryaprakash N
    Phys Chem Chem Phys; 2015 Mar; 17(11):7528-36. PubMed ID: 25706690
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Hydrogen bonding interactions in noradrenaline-DMSO complexes: DFT and QTAIM studies of structure, properties and topology.
    Huang Z; Dai Y; Yu L; Wang H
    J Mol Model; 2011 Oct; 17(10):2609-21. PubMed ID: 21258830
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Conformational analysis, stereoelectronic interactions and NMR properties of 2-fluorobicyclo[2.2.1]heptan-7-ols.
    de Rezende FM; Moreira MA; Cormanich RA; Freitas MP
    Beilstein J Org Chem; 2012; 8():1227-32. PubMed ID: 23019452
    [TBL] [Abstract][Full Text] [Related]  

  • 10. GIAO, DFT, AIM and NBO analysis of the N-H...O intramolecular hydrogen-bond influence on the 1J(N,H) coupling constant in push-pull diaminoenones.
    Afonin AV; Ushakov IA; Vashchenko AV; Kondrashov EV; Rulev AY
    Magn Reson Chem; 2010 Sep; 48(9):661-70. PubMed ID: 20661903
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Assessing Parameter Suitability for the Strength Evaluation of Intramolecular Resonance Assisted Hydrogen Bonding in
    Martínez-Cifuentes M; Monroy-Cárdenas M; Millas-Vargas JP; Weiss-López BE; Araya-Maturana R
    Molecules; 2019 Jan; 24(2):. PubMed ID: 30646498
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Aromaticity balance, π-electron cooperativity and H-bonding properties in tautomerism of salicylideneaniline: the quantum theory of atoms in molecules (QTAIM) approach.
    Karabıyık H; Sevinçek R; Petek H; Aygün M
    J Mol Model; 2011 Jun; 17(6):1295-309. PubMed ID: 20820826
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Conformational analysis and intramolecular interactions in monosubstituted phenylboranes and phenylboronic acids.
    Silla JM; Cormanich RA; Rittner R; Freitas MP
    Beilstein J Org Chem; 2013; 9():1127-34. PubMed ID: 23843904
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Bay-type H···H "bonding" in cis-2-butene and related species: QTAIM versus NBO description.
    Weinhold F; Schleyer Pv; McKee WC
    J Comput Chem; 2014 Jul; 35(20):1499-508. PubMed ID: 24920537
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Conformational Analysis and Electronic Interactions of Some 4'-Substituted-2-ethylthio-phenylacetates.
    Rodrigues DN; Ducati LC; Olivato PR; Dal Colle M
    J Phys Chem A; 2015 Apr; 119(16):3823-32. PubMed ID: 25839322
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Interactions of glutathione tripeptide with gold cluster: influence of intramolecular hydrogen bond on complexation behavior.
    Aliakbar Tehrani Z; Jamshidi Z; Jebeli Javan M; Fattahi A
    J Phys Chem A; 2012 May; 116(17):4338-47. PubMed ID: 22356446
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Conformational study of L-methionine and L-cysteine derivatives through quantum chemical calculations and
    Silva WGDP; Braga CB; Rittner R
    Beilstein J Org Chem; 2017; 13():925-937. PubMed ID: 28684974
    [TBL] [Abstract][Full Text] [Related]  

  • 18. How to determine whether intramolecular H...H interactions can be classified as dihydrogen bonds.
    Alkorta I; Elguero J; Grabowski SJ
    J Phys Chem A; 2008 Mar; 112(12):2721-7. PubMed ID: 18311957
    [TBL] [Abstract][Full Text] [Related]  

  • 19. S-H…O and O-H…O Hydrogen Bonds-Comparison of Dimers of Thiocarboxylic and Carboxylic Acids.
    Aarabi M; Gholami S; Grabowski SJ
    Chemphyschem; 2020 Aug; 21(15):1653-1664. PubMed ID: 32187829
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Conformational and NBO studies of serotonin as a radical scavenger. Changes induced by the OH group.
    Lobayan RM; Schmit MCP
    J Mol Graph Model; 2018 Mar; 80():224-237. PubMed ID: 29414042
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.