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Results: 1-16 |
Results: 16
Prediction of eye irritation from organic chemicals using membrane-interaction QSAR analysis
Authors: Kulkarni, A Hopfinger, AJ Osborne, R Bruner, LH Thompson, ED
Citation: A. Kulkarni et al., Prediction of eye irritation from organic chemicals using membrane-interaction QSAR analysis, TOXICOL SCI, 59(2), 2001, pp. 335-345
4D-QSPR analysis and virtual screening in materials science
Authors: Duca, JS Tseng, YF Hopfinger, AJ
Citation: Js. Duca et al., 4D-QSPR analysis and virtual screening in materials science, ADVAN MATER, 13(22), 2001, pp. 1713-1717
A search for sources of drug resistance by the 4D-QSAR analysis of a set of antimalarial dihydrofolate reductase inhibitors
Authors: Santos, OA Hopfinger, AJ
Citation: Oa. Santos et Aj. Hopfinger, A search for sources of drug resistance by the 4D-QSAR analysis of a set of antimalarial dihydrofolate reductase inhibitors, J COMPUT A, 15(1), 2001, pp. 1-12
4D-QSAR analysis of a set of ecdysteroids and a comparison to CoMFA modeling
Authors: Ravi, M Hopfinger, AJ Hormann, RE Dinan, L
Citation: M. Ravi et al., 4D-QSAR analysis of a set of ecdysteroids and a comparison to CoMFA modeling, J CHEM INF, 41(6), 2001, pp. 1587-1604
Estimation of molecular similarity based on 4D-QSAR analysis: Formalism and validation
Authors: Duca, JS Hopfinger, AJ
Citation: Js. Duca et Aj. Hopfinger, Estimation of molecular similarity based on 4D-QSAR analysis: Formalism and validation, J CHEM INF, 41(5), 2001, pp. 1367-1387
General anesthetic potencies of a series of propofol analogs correlate with potency for potentiation of gamma-aminobutyric acid (GABA) current at theGABA(A) receptor but not with lipid solubility
Authors: Krasowski, MD Jenkins, A Flood, P Kung, AY Hopfinger, AJ Harrison, NL
Citation: Md. Krasowski et al., General anesthetic potencies of a series of propofol analogs correlate with potency for potentiation of gamma-aminobutyric acid (GABA) current at theGABA(A) receptor but not with lipid solubility, J PHARM EXP, 297(1), 2001, pp. 338-351
Evaluation of alignment dependence in 3D-QSAR model construction using 4D-QSAR analysis
Authors: Hopfinger, AJ Vankatarangan, P Tseng, YF Wang, S Duca, JS
Citation: Aj. Hopfinger et al., Evaluation of alignment dependence in 3D-QSAR model construction using 4D-QSAR analysis, INTERNET J, 3(9-11), 2000, pp. NIL_23-NIL_42
Extraction of pharmacophore information from high-throughput screens
Authors: Hopfinger, AJ Duca, JS
Citation: Aj. Hopfinger et Js. Duca, Extraction of pharmacophore information from high-throughput screens, CURR OPIN B, 11(1), 2000, pp. 97-103
4D-QSPR analysis and virtual screening of calcite growth inhibitor libraries
Authors: Duca, JS Hopfinger, AJ
Citation: Js. Duca et Aj. Hopfinger, 4D-QSPR analysis and virtual screening of calcite growth inhibitor libraries, CHEM MATER, 12(12), 2000, pp. 3821-3829
Quantitative component analysis of mixtures for risk assessment: Application to eye irritation
Authors: Patel, HC Duca, JS Hopfinger, AJ Glendening, CD Thompson, ED
Citation: Hc. Patel et al., Quantitative component analysis of mixtures for risk assessment: Application to eye irritation, CHEM RES T, 12(11), 1999, pp. 1050-1056
Membrane-interaction QSAR analysis: Application to the estimation of eye irritation by organic compounds
Authors: Kulkarni, AS Hopfinger, AJ
Citation: As. Kulkarni et Aj. Hopfinger, Membrane-interaction QSAR analysis: Application to the estimation of eye irritation by organic compounds, PHARM RES, 16(8), 1999, pp. 1245-1253
Prediction of ligand-receptor binding free energy by 4D-QSAR analysis: Application to a set of glucose analogue inhibitors of glycogen phosphorylase
Authors: Venkatarangan, P Hopfinger, AJ
Citation: P. Venkatarangan et Aj. Hopfinger, Prediction of ligand-receptor binding free energy by 4D-QSAR analysis: Application to a set of glucose analogue inhibitors of glycogen phosphorylase, J CHEM INF, 39(6), 1999, pp. 1141-1150
Construction of a virtual nigh throughput screen by 4D-QSAR analysis: Application to a combinatorial library of glucose inhibitors of glycogen phosphorylase b
Authors: Hopfinger, AJ Reaka, A Venkatarangan, P Duca, JS Wang, S
Citation: Aj. Hopfinger et al., Construction of a virtual nigh throughput screen by 4D-QSAR analysis: Application to a combinatorial library of glucose inhibitors of glycogen phosphorylase b, J CHEM INF, 39(6), 1999, pp. 1151-1160
Synthesis, pharmacological and biophysical characterization, and membrane-interaction QSAR analysis of cationic amphiphilic model compounds. (vol 42,pg 3882, 1999)
Authors: Klein, CDP Klingmuller, M Schellinski, C Landmann, S Hauschild, S Heber, D Mohr, K Hopfinger, AJ
Citation: Cdp. Klein et al., Synthesis, pharmacological and biophysical characterization, and membrane-interaction QSAR analysis of cationic amphiphilic model compounds. (vol 42,pg 3882, 1999), J MED CHEM, 42(25), 1999, pp. 5288-5288
Synthesis, pharmacological and biophysical characterization, and membrane-interaction QSAR analysis of cationic amphiphilic model compounds
Authors: Klein, CDP Klingmuller, M Schellinski, C Landmann, S Hauschild, S Heber, D Mohr, K Hopfinger, AJ
Citation: Cdp. Klein et al., Synthesis, pharmacological and biophysical characterization, and membrane-interaction QSAR analysis of cationic amphiphilic model compounds, J MED CHEM, 42(19), 1999, pp. 3874-3888
Prediction of ligand-receptor binding thermodynamics by free energy force field three-dimensional quantitative structure-activity relationship analysis: Applications to a set of glucose analogue inhibitors of glycogen phosphorylase
Authors: Venkatarangan, P Hopfinger, AJ
Citation: P. Venkatarangan et Aj. Hopfinger, Prediction of ligand-receptor binding thermodynamics by free energy force field three-dimensional quantitative structure-activity relationship analysis: Applications to a set of glucose analogue inhibitors of glycogen phosphorylase, J MED CHEM, 42(12), 1999, pp. 2169-2179
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