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 *

127 related articles for article (PubMed ID: 33393778)

  • 61. Predominant torsional forms adopted by oligopeptide conformers in solution: parameters for molecular recognition.
    Marshall NJ; Grail BM; Payne JW
    J Pept Sci; 2001 Apr; 7(4):175-89. PubMed ID: 11354461
    [TBL] [Abstract][Full Text] [Related]  

  • 62. Structure and dynamics of the homologous series of alanine peptides: a joint molecular dynamics/NMR study.
    Graf J; Nguyen PH; Stock G; Schwalbe H
    J Am Chem Soc; 2007 Feb; 129(5):1179-89. PubMed ID: 17263399
    [TBL] [Abstract][Full Text] [Related]  

  • 63. Peptide models XLV: conformational properties of N-formyl-L-methioninamide and its relevance to methionine in proteins.
    Láng A; Csizmadia IG; Perczel A
    Proteins; 2005 Feb; 58(3):571-88. PubMed ID: 15616985
    [TBL] [Abstract][Full Text] [Related]  

  • 64. Combining ab initio quantum mechanics with a dipole-field model to describe acid dissociation reactions in water: first-principles free energy and entropy calculations.
    Maurer P; Iftimie R
    J Chem Phys; 2010 Feb; 132(7):074112. PubMed ID: 20170220
    [TBL] [Abstract][Full Text] [Related]  

  • 65. Unravelling Constant pH Molecular Dynamics in Oligopeptides with Explicit Solvation Model.
    Privat C; Madurga S; Mas F; Rubio-Martinez J
    Polymers (Basel); 2021 Sep; 13(19):. PubMed ID: 34641127
    [TBL] [Abstract][Full Text] [Related]  

  • 66. A Seamless Grid-Based Interface for Mean-Field QM/MM Coupled with Efficient Solvation Free Energy Calculations.
    Lim HK; Lee H; Kim H
    J Chem Theory Comput; 2016 Oct; 12(10):5088-5099. PubMed ID: 27585395
    [TBL] [Abstract][Full Text] [Related]  

  • 67. Role of substrate dynamics in protein prenylation reactions.
    Chakravorty DK; Merz KM
    Acc Chem Res; 2015 Feb; 48(2):439-48. PubMed ID: 25539152
    [TBL] [Abstract][Full Text] [Related]  

  • 68. Theoretical study on conformational energies of transition metal complexes.
    Bursch M; Hansen A; Pracht P; Kohn JT; Grimme S
    Phys Chem Chem Phys; 2021 Jan; 23(1):287-299. PubMed ID: 33336657
    [TBL] [Abstract][Full Text] [Related]  

  • 69. Conformational analysis of a polyconjugated protein-binding ligand by joint quantum chemistry and polarizable molecular mechanics. Addressing the issues of anisotropy, conjugation, polarization, and multipole transferability.
    Goldwaser E; de Courcy B; Demange L; Garbay C; Raynaud F; Hadj-Slimane R; Piquemal JP; Gresh N
    J Mol Model; 2014 Nov; 20(11):2472. PubMed ID: 25367040
    [TBL] [Abstract][Full Text] [Related]  

  • 70. Conformational analysis, part 43. A theoretical and LIS/NMR investigation of the conformations of substituted benzamides.
    Abraham RJ; Aboitiz N; Filippi M; Genesio E; Piaggio P; Sancassan F
    Magn Reson Chem; 2015 Jul; 53(7):498-508. PubMed ID: 26017265
    [TBL] [Abstract][Full Text] [Related]  

  • 71. The beta-turn scaffold of tripeptide containing an azaphenylalanine residue.
    Lee HJ; Park HM; Lee KB
    Biophys Chem; 2007 Jan; 125(1):117-26. PubMed ID: 16890344
    [TBL] [Abstract][Full Text] [Related]  

  • 72. Conformational study of peptides containing dehydrophenylalanine: helical structures without hydrogen bond.
    Nandel FS; Kaur H; Malik N; Shankar N; Jain DV
    Indian J Biochem Biophys; 2001 Dec; 38(6):417-25. PubMed ID: 11989673
    [TBL] [Abstract][Full Text] [Related]  

  • 73. Benchmark quantum-chemical calculations on a complete set of rotameric families of the DNA sugar-phosphate backbone and their comparison with modern density functional theory.
    Mládek A; Krepl M; Svozil D; Cech P; Otyepka M; Banáš P; Zgarbová M; Jurečka P; Sponer J
    Phys Chem Chem Phys; 2013 May; 15(19):7295-310. PubMed ID: 23575975
    [TBL] [Abstract][Full Text] [Related]  

  • 74. Evaluation of the conformational propensities of peptide isosteres as a basis for selecting bioactive pseudopeptides.
    Gupta S; Payne JW
    J Pept Res; 2001 Dec; 58(6):546-61. PubMed ID: 12005424
    [TBL] [Abstract][Full Text] [Related]  

  • 75. Comprehensive Benchmark of Association (Free) Energies of Realistic Host-Guest Complexes.
    Sure R; Grimme S
    J Chem Theory Comput; 2015 Aug; 11(8):3785-801. PubMed ID: 26574460
    [TBL] [Abstract][Full Text] [Related]  

  • 76. Conformational preferences of 1,4,7-trithiacyclononane: a molecular mechanics and density functional theory study.
    Jagannadh B; Reddy SS; Thangavelu RP
    J Mol Model; 2004 Feb; 10(1):55-9. PubMed ID: 14634846
    [TBL] [Abstract][Full Text] [Related]  

  • 77. Prediction of polyelectrolyte polypeptide structures using Monte Carlo conformational search methods with implicit solvation modeling.
    Evans JS; Chan SI; Goddard WA
    Protein Sci; 1995 Oct; 4(10):2019-31. PubMed ID: 8535238
    [TBL] [Abstract][Full Text] [Related]  

  • 78. Structures in solutions from joint experimental-computational analysis: applications to cyclic molecules and studies of noncovalent interactions.
    Aliev AE; Mia ZA; Khaneja HS; King FD
    J Phys Chem A; 2012 Jan; 116(3):1093-109. PubMed ID: 22204632
    [TBL] [Abstract][Full Text] [Related]  

  • 79. Ab initio-based exciton model of amide I vibrations in peptides: definition, conformational dependence, and transferability.
    Gorbunov RD; Kosov DS; Stock G
    J Chem Phys; 2005 Jun; 122(22):224904. PubMed ID: 15974713
    [TBL] [Abstract][Full Text] [Related]  

  • 80. Electronic Energies Are Not Enough: An Ion Mobility-Aided, Quantum Chemical Benchmark Analysis of H
    Beckett D; El-Baba TJ; Clemmer DE; Raghavachari K
    J Chem Theory Comput; 2018 Oct; 14(10):5406-5418. PubMed ID: 30192543
    [TBL] [Abstract][Full Text] [Related]  

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