Search Results - "Podlogar, Brent"

DNA Gyrase Inhibitory and Antimicrobial Activities of Some Diphenic Acid Monohydroxamides by Ohemeng, Kwasi A, Podlogar, Brent L, Nguyen, Van N, Bernstein, Jeffrey I, Krause, Heather M, Hilliard, Jamese J, Barrett, John F

“…The synthesis and inhibitory activity against DNA gyrase of a series of diphenic acid monohydroxamides 4a − f are described. A protocol of two biological…”
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Design, Synthesis, and Conformational Analysis of a Novel Macrocyclic HIV-Protease Inhibitor by Podlogar, Brent L, Farr, Robert A, Friedrich, Dirk, Tarnus, Celine, Huber, Edward W, Cregge, Robert J, Schirlin, Daniel

“…Design modifications to the lead HIV-PR inhibitor 1 (MDL 73,669, Ki = 5 nM) have been postulated based on a computational model of the 1/HIV-PR complex. A…”
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Synthesis and Inhibitory Activity of Novel Tri- and Tetracyclic Quinolines against Topoisomerases by Sui, Zhihua, Altom, Jason, Nguyen, Van N., Fernandez, Jeff, Bernstein, Jeff I., Hiliard, Jamese J., Barrett, John F., Podlogar, Brent L., Ohemeng, Kwasi A.

“…A series of isoindolo[2,1- a]- and pyrrolo[1,2- a]quinolines were designed and synthesized for DNA-gyrase and topoisomerase-II inhibition studies. Some of the…”
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NMR three-dimensional solution structure of the serine protease inhibitor cyclotheonamide A by McDonnell, Patricia A., Caldwell, Gary W., Leo, Gregory C., Podlogar, Brent L., Maryanoff, Bruce E.

“…The nmr solution conformation of cyclotheonamide A (CtA) was determined in aqueous media. The data produced 15 distance and 10 torsional constraints which were…”
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Molecular mechanics calculations of epoxides. Extension of the MM2 force field by Podlogar, Brent L, Raber, Douglas J

“…Alliger's MM2 force field has been extended to include epoxides. Structural parameters were obtained by determining values that gave best agreement between the…”
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Synthesis of Chiral Hydroxylated Quinolizidines via Vinylogous Bischler-Napieralski Nitrilium Ion Cyclizations by Marquart, Angela L, Podlogar, Brent L, Huber, Edward W, Demeter, David A, Peet, Norton P, Weintraub, Herschel J. R, Angelastro, Michael R

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Protein Structure Determination Using A Combination of Comparative Modeling and NMR Spectroscopy. Application to the Response Regulator Protein, Spo0F by Podlogar, Brent L, Leo, Gregory C, McDonnell, Patricia A, Loughney, Deborah A, Caldwell, Gary W, Barrett, John F

“…A practical combination of comparative modeling and NMR spectroscopy was used to generate a three-dimensional structure of the response regulator protein,…”
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A conformational criterion for aromaticity and antiaromaticity by Podlogar, Brent L, Glauser, William A, Rodriguez, Walter R, Raber, Douglas J

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Constrained analogs of CB-1 antagonists: 1,5,6,7-Tetrahydro-4H-pyrrolo[3,2-c]pyridine-4-one derivatives by Smith, Roger A., Fathi, Zahra, Brown, Su-Ellen, Choi, Soongyu, Fan, Jianmei, Jenkins, Susan, Kluender, Harold C.E., Konkar, Anish, Lavoie, Rico, Mays, Ronald, Natoli, Jennifer, O’Connor, Stephen J., Ortiz, Astrid A., Podlogar, Brent, Taing, Christy, Tomlinson, Susan, Tritto, Theresa, Zhang, Zhonghua

“…Pyrrolopyridinones were designed and established as potent constrained analogs of the pyrazole CB-1 receptor antagonist/inverse agonist rimonabant. A…”
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Conformational analysis of the endogenous μ-opioid agonist endomorphin-1 using NMR spectroscopy and molecular modeling by Podlogar, Brent L., Paterlini, M.Germana, Ferguson, David M., Leo, Gregory C., Demeter, David A., Brown, Frank K., Reitz, Allen B.

“…Endomorphin-1 (Tyr-Pro-Trp-Phe-NH 2) is a highly selective and potent agonist of the μ-opioid receptor. To identify structural attributes unique to this opioid…”
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QSAR and CoMFA: a perspective on the practical application to drug discovery by Podlogar, B L, Ferguson, D M

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Synthesis and evaluation of 4-(N,N-diarylamino)piperidines with high selectivity to the delta-opioid receptor: a combined 3D-QSAR and ligand docking study by Podlogar, B L, Poda, G I, Demeter, D A, Zhang, S P, Carson, J R, Neilson, L A, Reitz, A B, Ferguson, D M

“…A series of 4-(N,N-diarylamino)piperidines are synthesized and evaluated for high affinity binding and selectivity to the delta-opioid receptor using a…”
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3D-Quantitative Structure Activity Relationships of Biphenyl Carboxylic Acid MMP-3 Inhibitors: Exploring Automated Docking as Alignment Method by Muegge, Ingo, Podlogar, Brent L.

“…A series of CoMFA models have been derived from docking‐based and atom‐based alignments. The statistics of these approaches has been compared to determine…”
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Halogen substituted adamantanones. Structural studies with lanthanide shift reagents by HAJEK, M, HORSKA, A, TRSKA, P, VODICKA, L, RABER, D. J, PODLOGAR, B. L, PETERS, J. A

“…Europium shift reagents (both FOD and DPM) have been used to study a series of halogen substituted adamantanones by 1 H NMR spectroscopy. Reliable correlations…”
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