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 *

223 related articles for article (PubMed ID: 19239274)

  • 1. Partial charge calculation method affects CoMFA QSAR prediction accuracy.
    Mittal RR; Harris L; McKinnon RA; Sorich MJ
    J Chem Inf Model; 2009 Mar; 49(3):704-9. PubMed ID: 19239274
    [TBL] [Abstract][Full Text] [Related]  

  • 2. A comparison of different electrostatic potentials on prediction accuracy in CoMFA and CoMSIA studies.
    Tsai KC; Chen YC; Hsiao NW; Wang CL; Lin CL; Lee YC; Li M; Wang B
    Eur J Med Chem; 2010 Apr; 45(4):1544-51. PubMed ID: 20110138
    [TBL] [Abstract][Full Text] [Related]  

  • 3. A comparative molecular field analysis (CoMFA) study using semiempirical, density functional, ab initio methods and pharmacophore derivation using DISCOtech on sigma 1 ligands.
    Jung D; Floyd J; Gund TM
    J Comput Chem; 2004 Aug; 25(11):1385-99. PubMed ID: 15185333
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Different electrostatic descriptors in comparative molecular field analysis: A comparison of molecular electrostatic and coulomb potentials.
    Kroemer RT; Hecht P; Liedl KR
    J Comput Chem; 1996 Aug; 17(11):1296-308. PubMed ID: 25400148
    [TBL] [Abstract][Full Text] [Related]  

  • 5. CoMFA modeling of human catechol O-methyltransferase enzyme kinetics.
    Sipilä J; Taskinen J
    J Chem Inf Comput Sci; 2004; 44(1):97-104. PubMed ID: 14741015
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Enhancement of ordinal CoMFA by ridge logistic partial least squares.
    Ohgaru T; Shimizu R; Okamoto K; Kawashita N; Kawase M; Shirakuni Y; Nishikiori R; Takagi T
    J Chem Inf Model; 2008 Apr; 48(4):910-7. PubMed ID: 18338844
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A comparison of methods for modeling quantitative structure-activity relationships.
    Sutherland JJ; O'Brien LA; Weaver DF
    J Med Chem; 2004 Oct; 47(22):5541-54. PubMed ID: 15481990
    [TBL] [Abstract][Full Text] [Related]  

  • 8. 3D-QSAR CoMFA of a series of DABO derivatives as HIV-1 reverse transcriptase non-nucleoside inhibitors.
    de Brito MA; Rodrigues CR; Cirino JJ; de Alencastro RB; Castro HC; Albuquerque MG
    J Chem Inf Model; 2008 Aug; 48(8):1706-15. PubMed ID: 18671385
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Three-dimensional quantitative structure-property relationship (3D-QSPR) models for prediction of thermodynamic properties of polychlorinated biphenyls (PCBs): enthalpies of fusion and their application to estimates of enthalpies of sublimation and aqueous solubilities.
    Puri S; Chickos JS; Welsh WJ
    J Chem Inf Comput Sci; 2003; 43(1):55-62. PubMed ID: 12546538
    [TBL] [Abstract][Full Text] [Related]  

  • 10. 3D-QSAR studies of boron-containing dipeptides as proteasome inhibitors with CoMFA and CoMSIA methods.
    Zhu YQ; Lei M; Lu AJ; Zhao X; Yin XJ; Gao QZ
    Eur J Med Chem; 2009 Apr; 44(4):1486-99. PubMed ID: 18771818
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Multilinear regression and comparative molecular field analysis (CoMFA) of azo dye-fiber affinities. 2. Inclusion of solution-phase molecular orbital descriptors.
    Schüürmann G; Funar-Timofei S
    J Chem Inf Comput Sci; 2003; 43(5):1502-12. PubMed ID: 14502484
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Modeling robust QSAR. 2. iterative variable elimination schemes for CoMSA: application for modeling benzoic acid pKa values.
    Gieleciak R; Polanski J
    J Chem Inf Model; 2007; 47(2):547-56. PubMed ID: 17381172
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Quantitative structure-activity relationships for a series of inhibitors of cruzain from Trypanosoma cruzi: molecular modeling, CoMFA and CoMSIA studies.
    Trossini GH; Guido RV; Oliva G; Ferreira EI; Andricopulo AD
    J Mol Graph Model; 2009 Aug; 28(1):3-11. PubMed ID: 19376735
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Ordinal classification using Comparative Molecular Field Analysis.
    Ohgaru T; Shimizu R; Okamoto K; Kawase M; Shirakuni Y; Nishikiori R; Takagi T
    J Chem Inf Model; 2008 Jan; 48(1):207-12. PubMed ID: 18161957
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Inductive electronegativity scale. Iterative calculation of inductive partial charges.
    Cherkasov A
    J Chem Inf Comput Sci; 2003; 43(6):2039-47. PubMed ID: 14632456
    [TBL] [Abstract][Full Text] [Related]  

  • 16. General Purpose Electronegativity Relaxation Charge Models Applied to CoMFA and CoMSIA Study of GSK-3 Inhibitors.
    Tsareva DA; Osolodkin DI; Shulga DA; Oliferenko AA; Pisarev SA; Palyulin VA; Zefirov NS
    Mol Inform; 2011 Mar; 30(2-3):169-80. PubMed ID: 27466771
    [TBL] [Abstract][Full Text] [Related]  

  • 17. A comparative study of quantitative structure-activity relationship methods based on gallic acid derivatives.
    Huang H; Ou W; Zhao J; Chen D; Wang L
    SAR QSAR Environ Res; 2004 Apr; 15(2):83-99. PubMed ID: 15199945
    [TBL] [Abstract][Full Text] [Related]  

  • 18. The use of atomic charges and orbital energies as hydrogen-bonding-donor parameters for QSAR studies: comparison of MNDO, AM1 and PM3 methods.
    Ghafourian T; Dearden JC
    J Pharm Pharmacol; 2000 Jun; 52(6):603-10. PubMed ID: 10875535
    [TBL] [Abstract][Full Text] [Related]  

  • 19. 3D-QSAR studies for the binding affinity toward (R, S)-2-amino-3-(3-hydroxy-5-methylisoxazol-4-yl)-propionic acid receptor.
    Sharma RN; Thakar H; Vasu KK; Chaturvedi SC
    Acta Pharm; 2008 Sep; 58(3):335-45. PubMed ID: 19103570
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Comparing the performance of FLUFF-BALL to SEAL-CoMFA with a large diverse estrogen data set: from relevant superpositions to solid predictions.
    Korhonen SP; Tuppurainen K; Laatikainen R; Peräkylä M
    J Chem Inf Model; 2005; 45(6):1874-83. PubMed ID: 16309295
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 12.