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: 31246457)

  • 41. Electronic coupling calculation and pathway analysis of electron transfer reaction using ab initio fragment-based method. I. FMO-LCMO approach.
    Nishioka H; Ando K
    J Chem Phys; 2011 May; 134(20):204109. PubMed ID: 21639426
    [TBL] [Abstract][Full Text] [Related]  

  • 42. Quantum chemical calculations, vibrational studies, HOMO-LUMO and NBO/NLMO analysis of 2-bromo-5-nitrothiazole.
    Gobinath E; Xavier RJ
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Mar; 104():394-402. PubMed ID: 23274373
    [TBL] [Abstract][Full Text] [Related]  

  • 43. A new method for filtering of reactive "warheads" of transition-state analog protease inhibitors.
    Traube T; Shokhen M; Albeck A
    Eur J Med Chem; 2014 Apr; 77():134-8. PubMed ID: 24631732
    [TBL] [Abstract][Full Text] [Related]  

  • 44. Acrylamide in polyacrylamide gels can modify proteins during electrophoresis.
    Bonaventura C; Bonaventura J; Stevens R; Millington D
    Anal Biochem; 1994 Oct; 222(1):44-8. PubMed ID: 7856869
    [TBL] [Abstract][Full Text] [Related]  

  • 45. Fragment quantum mechanical calculation of proteins and its applications.
    He X; Zhu T; Wang X; Liu J; Zhang JZ
    Acc Chem Res; 2014 Sep; 47(9):2748-57. PubMed ID: 24851673
    [TBL] [Abstract][Full Text] [Related]  

  • 46. Topological analysis (BCP) of vibrational spectroscopic studies, docking, RDG, DSSC, Fukui functions and chemical reactivity of 2-methylphenylacetic acid.
    Kavimani M; Balachandran V; Narayana B; Vanasundari K; Revathi B
    Spectrochim Acta A Mol Biomol Spectrosc; 2018 Feb; 190():47-60. PubMed ID: 28898821
    [TBL] [Abstract][Full Text] [Related]  

  • 47. Evaluation of structure-reactivity descriptors and biological activity spectra of 4-(6-methoxy-2-naphthyl)-2-butanone using spectroscopic techniques.
    Agrawal M; Deval V; Gupta A; Sangala BR; Prabhu SS
    Spectrochim Acta A Mol Biomol Spectrosc; 2016 Oct; 167():142-156. PubMed ID: 27284764
    [TBL] [Abstract][Full Text] [Related]  

  • 48. Integrated Synthetic, Biophysical, and Computational Investigations of Covalent Inhibitors of Prolyl Oligopeptidase and Fibroblast Activation Protein α.
    Plescia J; De Cesco S; Patrascu MB; Kurian J; Di Trani J; Dufresne C; Wahba AS; Janmamode N; Mittermaier AK; Moitessier N
    J Med Chem; 2019 Sep; 62(17):7874-7884. PubMed ID: 31393718
    [TBL] [Abstract][Full Text] [Related]  

  • 49. Importance of C-N bond rotation in N-acyl oxazolidinones in their SmI2-promoted coupling to acrylamides.
    Taaning RH; Lindsay KB; Schiøtt B; Daasbjerg K; Skrydstrup T
    J Am Chem Soc; 2009 Jul; 131(29):10253-62. PubMed ID: 19580282
    [TBL] [Abstract][Full Text] [Related]  

  • 50. Quantum mechanical study and spectroscopic (FT-IR, FT-Raman, UV-Visible) study, potential energy surface scan, Fukui function analysis and HOMO-LUMO analysis of 3-tert-butyl-4-methoxyphenol by DFT methods.
    Saravanan S; Balachandran V
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep; 130():604-20. PubMed ID: 24813291
    [TBL] [Abstract][Full Text] [Related]  

  • 51. Reactions between aromatic hydrocarbons and heterocycles: covalent and proton-bound dimer cations of benzene/pyridine.
    El-Shall MS; Ibrahim YM; Alsharaeh EH; Meot-Ner Mautner M; Watson SP
    J Am Chem Soc; 2009 Jul; 131(29):10066-76. PubMed ID: 19621961
    [TBL] [Abstract][Full Text] [Related]  

  • 52. Development of a Fragment-Based in Silico Profiler for Michael Addition Thiol Reactivity.
    Ebbrell DJ; Madden JC; Cronin MT; Schultz TW; Enoch SJ
    Chem Res Toxicol; 2016 Jun; 29(6):1073-81. PubMed ID: 27100370
    [TBL] [Abstract][Full Text] [Related]  

  • 53. Spectroscopic and molecular structure (monomeric and dimeric model) investigation of Febuxostat: A combined experimental and theoretical study.
    Pandey J; Prajapati P; Srivastava A; Tandon P; Sinha K; Ayala AP; Bansal AK
    Spectrochim Acta A Mol Biomol Spectrosc; 2018 Oct; 203():1-12. PubMed ID: 29852375
    [TBL] [Abstract][Full Text] [Related]  

  • 54. Conformational stability, spectroscopic and computational studies, HOMO-LUMO, NBO, ESP analysis, thermodynamic parameters of natural bioactive compound with anticancer potential of 2-(hydroxymethyl)anthraquinone.
    Balachandran V; Karpagam V; Revathi B; Kavimani M; Ilango G
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Nov; 150():631-40. PubMed ID: 26093112
    [TBL] [Abstract][Full Text] [Related]  

  • 55. Covalent inhibitors design and discovery.
    De Cesco S; Kurian J; Dufresne C; Mittermaier AK; Moitessier N
    Eur J Med Chem; 2017 Sep; 138():96-114. PubMed ID: 28651155
    [TBL] [Abstract][Full Text] [Related]  

  • 56. Recent progress in covalent warheads for in vivo targeting of endogenous proteins.
    Shindo N; Ojida A
    Bioorg Med Chem; 2021 Oct; 47():116386. PubMed ID: 34509863
    [TBL] [Abstract][Full Text] [Related]  

  • 57. Proceedings of the Second Workshop on Theory meets Industry (Erwin-Schrödinger-Institute (ESI), Vienna, Austria, 12-14 June 2007).
    Hafner J
    J Phys Condens Matter; 2008 Feb; 20(6):060301. PubMed ID: 21693862
    [TBL] [Abstract][Full Text] [Related]  

  • 58. Ab-initio and DFT calculations on molecular structure, NBO, HOMO-LUMO study and a new vibrational analysis of 4-(Dimethylamino) Benzaldehyde.
    Rocha M; Di Santo A; Arias JM; Gil DM; Ben Altabef A
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():635-43. PubMed ID: 25448963
    [TBL] [Abstract][Full Text] [Related]  

  • 59. The effect of defect types on the electronic and optical properties of graphene nanoflakes physisorbed by ionic liquids.
    Shakourian-Fard M; Kamath G
    Phys Chem Chem Phys; 2017 Feb; 19(6):4383-4395. PubMed ID: 28119976
    [TBL] [Abstract][Full Text] [Related]  

  • 60. Identification of Covalent Binding Sites Targeting Cysteines Based on Computational Approaches.
    Zhang Y; Zhang D; Tian H; Jiao Y; Shi Z; Ran T; Liu H; Lu S; Xu A; Qiao X; Pan J; Yin L; Zhou W; Lu T; Chen Y
    Mol Pharm; 2016 Sep; 13(9):3106-18. PubMed ID: 27483186
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 7.