Flemming Steen Jørgensen

Flemming Steen Jørgensen

Professor


  1. Published

    1,2‐Oxathiolane – A Photoelectron Spectroscopic Study. / Jørgensen, Flemming S.; Carlsen, Lars.

    In: Chemische Berichte, Vol. 116, No. 6, 01.01.1983, p. 2374-2377.

    Research output: Contribution to journalJournal articleResearchpeer-review

  2. Published

    3-mercaptopropanal. / Carlsen, Lars; Jørgensen, Flemming S.; Egsgaard, Helge; Nicolaisen, Flemming M.

    In: Journal of the Chemical Society, Perkin Transactions 2, No. 4, 01.01.1984, p. 609-613.

    Research output: Contribution to journalJournal articleResearchpeer-review

  3. Published

    3D-QSAR. Towards a quantitative three-dimensional description of muscarinic agonists. / Lagersted, A.; Jørgensen, F. S.

    In: Progress in Clinical and Biological Research, Vol. 291, 01.01.1989, p. 333-336.

    Research output: Contribution to journalJournal articleResearchpeer-review

  4. Published

    In silico predictions of hERG channel blockers in drug discovery : from ligand-based and target-based approaches to systems chemical biology. / Taboureau, Olivier; Jørgensen, Flemming Steen.

    In: Combinatorial Chemistry & High Throughput Screening, Vol. 14, No. 5, 06.2011, p. 375-387.

    Research output: Contribution to journalJournal articleResearchpeer-review

  5. Published

    A diversity optimized combinatorial library for the identification of Fc-fragment binding ligands. / Nielsen, Anders L; Jørgensen, Flemming Steen; Olsen, Lars; Christensen, Søren F; Benie, Andrew J; Bjørnholm, Thomas; St. Hilaire, Phaedria M.

    In: Biopolymers, Vol. 94, No. 2, 2010, p. 192-205.

    Research output: Contribution to journalJournal articleResearchpeer-review

  6. Published

    A new concept for multidimensional selection of ligand conformations (MultiSelect) and multidimensional scoring (MultiScore) of protein-ligand binding affinities. / Terp, G E; Johansen, B N; Christensen, I T; Jørgensen, Flemming Steen.

    In: Journal of Medicinal Chemistry, Vol. 44, No. 14, 2001, p. 2333-43.

    Research output: Contribution to journalJournal articleResearchpeer-review

  7. Published

    A quantitative structure-activity relationship for translocation of tripeptides via the human proton-coupled peptide transporter, hPEPT1 (SLC15A1). / Omkvist, Diana Højmark; Larsen, Simon Birksø; Nielsen, Carsten Uhd; Steffansen, Bente; Olsen, Lars; Jørgensen, Flemming Steen; Larsen, Birger Brodin.

    In: The AAPS Journal, Vol. 12, No. 3, 2010, p. 385-396.

    Research output: Contribution to journalJournal articleResearchpeer-review

  8. Published

    A robust force field based method for calculating conformational energies of charged drug-like molecules. / Pøhlsgaard, Jacob; Harpsøe, Kasper; Jørgensen, Flemming Steen; Olsen, Lars.

    In: Journal of Chemical Information and Modeling, Vol. 52, No. 2, 2012, p. 409-419.

    Research output: Contribution to journalJournal articleResearchpeer-review

  9. Published

    A steered molecular dynamics study of binding and translocation processes in the GABA transporter. / Skovstrup, Søren; David, Laurent; Taboureau, Olivier; Jørgensen, Flemming Steen.

    In: P L o S One, Vol. 7, No. 6, 2012, p. e39360.

    Research output: Contribution to journalJournal articleResearchpeer-review

  10. Published

    AMPA receptor agonists: structural, conformational and stereochemical aspects. / Hansen, JJ; Jørgensen, FS; Lund, Trine Meldgaard; Nielsen, B; Reinhardt, A; Breum, I; Brehm, L; Krogsgaard-Larsen, P.

    Excitatory Amino Acid Receptors. ed. / Povl Krogsgaard-Larsen; Jan J Hansen. Ellis Horwood: Chichester, 1992.

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  11. Published

    Aldehyde Oxidase: Reaction Mechanism and Prediction of Site of Metabolism. / Montefiori, Marco; Jorgensen, Flemming Steen; Olsen, Lars.

    In: ACS Omega, Vol. 2, No. 8, 08.2017, p. 4237-4244.

    Research output: Contribution to journalJournal articleResearchpeer-review

  12. Published

    An Optimized Screen Reduces the Number of GA Transporters and Provides Insights Into Nitrate Transporter 1/Peptide Transporter Family Substrate Determinants. / Wulff, Nikolai; Ernst, Heidi Asschenfeldt; Jørgensen, Morten Egevang; Lambertz, Sophie; Maierhofer, Tobias; Belew, Zeinu Mussa; Crocoll, Christoph; Motawia, Mohammed Saddik; Geiger, Dietmar; Jørgensen, Flemming Steen; Mirza, Osman; Nour-Eldin, Hussam Hassan.

    In: Frontiers in Plant Science, Vol. 10, 03.10.2019.

    Research output: Contribution to journalJournal articleResearchpeer-review

  13. Published

    Anti,anti acetals : Photoelectron spectroscopy of trans-1,8-dioxadecalins. / Jørgensen, Flemming Steen; Nørskov-Lauritsen, Leif.

    In: Tetrahedron Letters, Vol. 23, No. 49, 1982, p. 5221 - 5224.

    Research output: Contribution to journalJournal articleResearchpeer-review

  14. Published

    Assessing the relative importance of the biophysical properties of amino acid substitutions associated with human genetic disease. / Terp, Bent N; Cooper, David N; Christensen, Inge T; Jørgensen, Flemming Steen; Bross, Peter Gerd; Gregersen, Niels; Krawczak, Michael.

    In: Human Mutation, Vol. 20, No. 2, 2002, p. 98-109.

    Research output: Contribution to journalJournal articleResearchpeer-review

  15. Published

    Biostructure-based drug design. / Jørgensen, Flemming Steen; Kastrup, Jette Sandholm.

    Textbook of drug design and discovery. ed. / Povl Krogsgaard-Larsen; Kristian Strømgaard; Ulf Madsen. 4. ed. Boca Raton : CRC Press, 2010. p. 29-42.

    Research output: Chapter in Book/Report/Conference proceedingBook chapterEducation

  16. Published

    Both Reactivity and Accessibility Are Important in Cytochrome P450 Metabolism : A Combined DFT and MD Study of Fenamic Acids in BM3 Mutants. / Leth, Rasmus; Ercig, Bogac; Olsen, Lars; Jørgensen, Flemming Steen.

    In: Journal of Chemical Information and Modeling, Vol. 59, No. 2, 25.02.2019, p. 743-753.

    Research output: Contribution to journalJournal articleResearchpeer-review

  17. Published

    Classification of cytochrome P450 1A2 inhibitors and noninhibitors by machine learning techniques. / Poongavanam, Vasanthanathan; Taboureau, Olivier; Oostenbrink, Chris; Vermeulen, Nico P E; Olsen, Lars; Jørgensen, Flemming Steen.

    In: Drug Metabolism and Disposition, Vol. 37, No. 3, 2009, p. 658-664.

    Research output: Contribution to journalJournal articleResearchpeer-review

  18. Published

    Computational prediction of binding affinity for CYP1A2-ligand complexes using empirical free energy calculations. / Poongavanam, Vasanthanathan; Olsen, Lars; Jørgensen, Flemming Steen; Vermeulen, Nico P E; Oostenbrink, Chris.

    In: Drug Metabolism and Disposition, Vol. 38, No. 8, 2010, p. 1347-1354.

    Research output: Contribution to journalJournal articleResearchpeer-review

  19. Published

    Computational prediction of solubilizers' effect on partitioning. / Høst, Jan; Christensen, Inge Thøger; Jørgensen, Flemming Steen; Frøkjær, Sven; Hovgaard, Lars.

    In: Internation Journal of Pharmaceutics, Vol. 329, No. 1-2, 2007, p. 46-52.

    Research output: Contribution to journalJournal articleResearchpeer-review

  20. Published

    Computeren er medicinalkemikerens arbejdshest. / Larsen, Simon Birksø; Olsen, Lars; Jørgensen, Flemming Steen.

    In: Lægemiddelforskning, 2009, p. 7-9.

    Research output: Contribution to journalJournal articleCommunication

  21. Published

    Computeren kan forudsige lægemidlers omdannelse. / Olsen, Lars; Bergmann, Rikke; Jørgensen, Flemming Steen.

    In: Lægemiddelforskning 2004, 2004.

    Research output: Contribution to journalJournal articleResearch

  22. Published

    Conformational analysis and molecular modelling of a partial GABA(A) agonist and a glycine antagonist related to the GABA(A) agonist, THIP. / Byberg Buur, J. R.; Hjeds, H.; Krogsgaard-Larsen, P.; Jorgensen, F. S.

    In: Drug Design and Discovery, Vol. 10, No. 3, 01.12.1993, p. 213-229.

    Research output: Contribution to journalJournal articleResearchpeer-review

  23. Published

    Conformational analysis of peri-interactions in napththalene derivatives. Ring inversion in CH2–X–CH2-bridged peri-naphthalenes. / Anderson, J Edgar; Jørgensen, Flemming Steen.

    In: Journal of the Chemical Society. Perkin Transactions 2 (2001), Vol. 1988, No. 4, 01.04.1988, p. 469-471.

    Research output: Contribution to journalJournal articleResearchpeer-review

  24. Published

    Conformational analysis of six- and twelve-membered ring compounds by molecular dynamics. / Christensen, I T; Jørgensen, Flemming Steen.

    In: Journal of Computer - Aided Molecular Design, Vol. 11, No. 4, 1997, p. 385-94.

    Research output: Contribution to journalJournal articleResearchpeer-review

  25. Published

    Conformational analysis of the fungicide fenpropimorph by molecular mechanics calculations and NMR spectroscopy. / Jensen, Jette Sandholm ; Jørgensen, Flemming Steen; Klemmensen, Per D.; Hacksell, Uli; Petersson, Ingrid.

    In: Journal of Pesticide Science, Vol. 36, 1992, p. 309-318.

    Research output: Contribution to journalJournal articleResearchpeer-review

  26. Published

    Conformational and pharmacological characterization of 4-AHCP, a bicyclic homologue of the excitatory amino acid receptor agonist AMPA. / Lund, Trine Meldgaard; Madsen, U; Ebert, B; Jorgensen, FS; Krogsgaard-Larsen, P.

    In: Med. Chem. Res, Vol. 1, 1991, p. 136-141.

    Research output: Contribution to journalJournal articleResearchpeer-review

  27. Published

    Conformational restrictions in ligand binding to the human intestinal di-/tripeptide transporter : implications for design of hPEPT1 targeted prodrugs. / Våbenø, Jon; Nielsen, Carsten Uhd; Steffansen, Bente; Lejon, Tore; Sylte, Ingebrigt; Jørgensen, Flemming Steen; Luthman, Kristina.

    In: Bioorganic & Medicinal Chemistry, Vol. 13, No. 6, 2005, p. 1977-88.

    Research output: Contribution to journalJournal articleResearchpeer-review

  28. Published

    Conservation of a helix-stabilizing dipole moment in the PP-fold family of regulatory peptides. / Bjørnholm, B; Jørgensen, Flemming Steen; Schwartz, T W.

    In: Biochemistry, Vol. 32, No. 12, 1993, p. 2954-9.

    Research output: Contribution to journalJournal articleResearchpeer-review

  29. Published

    Correlations between Core Photoionization Energies (EB1s) and Gas-Phase Basicity. A General Method for Determining Sites of Protonation and Intramolecular Ion Reorganization Energies. / Buschek, J. M.; Jørgensen, F. S.; Brown, R. S.

    In: Journal of the American Chemical Society, Vol. 104, No. 19, 01.01.1982, p. 5019-5025.

    Research output: Contribution to journalJournal articleResearchpeer-review

  30. Published

    Crystal and Molecular Structure of Di- tert-adamantyl Disulfide. Extension of the Correlation between the Sulfur-Sulfur Dihedral Angle and the Sulfur Lone-Pair Energy Gap. / Rindorf, Grethe; Jorgensen, Flemming S.; Snyder, James P.

    In: Journal of Organic Chemistry, Vol. 45, No. 26, 01.01.1980, p. 5343-5347.

    Research output: Contribution to journalJournal articleResearchpeer-review

  31. Published

    Crystal and Molecular Structure of anti-Sesquinorbornene. / Gaihede, Michael; Jørgensen, Flemming S.; Kopecky, Karl R.; Watson, William H.; Kashyap, Ram P.

    In: Journal of Organic Chemistry, Vol. 50, No. 22, 01.01.1985, p. 4395-4397.

    Research output: Contribution to journalJournal articleResearchpeer-review

  32. Published

    Crystal structure of merosinigrin, an (ap,ap)-monothioacetal; structural properties of the thioglycosidic linkage. / Nørskov-Lauritsen, Leif; Jørgensen, Flemming S.; Jaroszewski, Jerzy W.

    In: Carbohydrate Research, Vol. 123, No. 1, 11.11.1983, p. 1-11.

    Research output: Contribution to journalJournal articleResearchpeer-review

  33. Published

    Crystal structures and photoelectron spectra of some trimethanoanthracenes, tetramethanonaphthacenes, and pentamethanopentacenes. Experimental evidence for laticyclic hyperconjugation. / Paddon-Row, Michael N.; Englehardt, Lutz M.; Skelton, Brian W.; White, Allan H.; Jørgensen, Flemming Steen; Patney, Harish K.

    In: J. Chem. Soc., Perkin Trans. 2, 1987, p. 1835-1850.

    Research output: Contribution to journalJournal articleResearchpeer-review

  34. Published

    Crystallization and preliminary X-ray analysis of a PNA-DNA complex. / Kastrup, Jette Sandholm Jensen; Pilgaard, Michael; Jørgensen, Flemming Steen; Nielsen, Peter E.; Rasmussen, Hanne B.

    In: FEBS Letters, Vol. 363, 1995, p. 115-117.

    Research output: Contribution to journalJournal articleResearchpeer-review

  35. Published

    Cyclic Acetals. Structural Analysis of 1,3‐Dioxepine and Related Compounds. / Jørgensen, Flemming S.; Gajhede, Michael; Frei, Bruno.

    In: Helvetica Chimica Acta, Vol. 68, No. 8, 01.01.1985, p. 2148-2157.

    Research output: Contribution to journalJournal articleResearchpeer-review

  36. Published

    Cyclynes. Part 5. Pericyclynes: "exploded cycloalkanes" with unusual orbital interactions and conformational properties. MM2 and STO-3G calculations, x-ray crystal structures, photoelectron spectra, and electron transmission spectra. / Houk, K. N.; Scott, Lawrence T.; Rondan, Nelson G.; Spellmeyer, David C.; Reinhardt, Gerd; Hyun, James L.; DeCicco, Gary J.; Weiss, Robert; Chen, Marie H. M.; Bass, Lawrence S.; Clardy, Jon; Jørgensen, Flemming Steen; Eaton, Thomas A.; Sarkozi, Victor; Petit, Christina M.; Ng, Lily; Jordan, Kenneth D.

    In: Journal of the American Chemical Society, Vol. 107, No. 23, 1985, p. 6556-6562.

    Research output: Contribution to journalJournal articleResearchpeer-review

  37. Published

    Cytochrome P450 Mediated Drug Metabolism. / Olsen, Lars; Jørgensen, Flemming Steen; Oostenbrink, Chris.

    New Horizons in Predictive Drug Metabolism and Pharmacokinetics. ed. / Alan G.E. Wilson. Cambridge : Royal Society of Chemistry, 2016. p. 66-78 (RSC Drug Discovery, Vol. 49).

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  38. Published

    Density functional theory study on the formation of reactive benzoquinone imines by hydrogen abstraction. / Leth, Rasmus; Rydberg, Patrik; Jørgensen, Flemming Steen; Olsen, Lars.

    In: Journal of Chemical Information and Modeling, Vol. 55, No. 3, 23.03.2015, p. 660-6.

    Research output: Contribution to journalJournal articleResearchpeer-review

  39. Published

    Design of prodrugs targeting the intestinal di/tri‐peptide transporter hPEPT1 (SLC15A1. / Omkvist, Diana Højmark; Nielsen, Carsten Uhd; Steffansen, Bente; Larsen, Simon Birksø; Olsen, Lars; Jørgensen, Flemming Steen; Brodin, Birger.

    2014. Abstract from Meet the Experts: Transporter Conference- 2014, Budapest, Hungary.

    Research output: Contribution to conferenceConference abstract for conferenceResearchpeer-review

  40. Published

    Determination of protein conformation by isotopically labelled cross-linking and dedicated software: Application to the chaperone, calreticulin. / Nielsen, Tina; Thaysen-Andersen, Morten; Larsen, Nanna; Jørgensen, Flemming Steen; Houen, Gunnar; Højrup, Peter.

    In: International Journal of Mass Spectrometry, Vol. 268, No. 2-3, 2007, p. 217-226.

    Research output: Contribution to journalJournal articleResearchpeer-review

  41. Published

    Determination of ring inversion barriers for 1H,3H-naphtho[1,8-cd]-pyran and its methyl substituted derivatives by molecular mechanics calculations and dynamic nuclear magnetic resonance spectroscopy. / Anderson, J. Edgar; Jørgensen, Flamming S.

    In: Journal of the Chemical Society, Perkin Transactions 2, No. 4, 01.01.1981, p. 741-746.

    Research output: Contribution to journalJournal articleResearchpeer-review

  42. Published

    Development of a QSAR model for binding of tripeptides and tripeptidomimetics to the human intestinal di-/tripeptide transporter hPEPT1. / Andersen, Rikke; Jørgensen, Flemming Steen; Olsen, Lars; Våbenø, Jon; Thorn, Karina; Nielsen, Carsten Uhd; Steffansen, Bente.

    In: Pharmaceutical Research, Vol. 23, No. 3, 2006, p. 483-92.

    Research output: Contribution to journalJournal articleResearchpeer-review

  43. Published

    Discovery of ligands for the human intestinal di-/tripeptide transporter (hPEPT1) using af QSAR-assisted virtual screening strategy. / Larsen, Simon Birksø; Omkvist, Diana Højmark; Larsen, Birger Brodin; Nielsen, Carsten Uhd; Steffansen, Bente; Olsen, Lars; Jørgensen, Flemming Steen.

    In: ChemMedChem, Vol. 4, No. 9, 2009, p. 1439-1445.

    Research output: Contribution to journalJournal articleResearchpeer-review

  44. Published

    Dissecting the Cytochrome P450 1A2- and 3A4-Mediated Metabolism of Aflatoxin B1 in Ligand and Protein Contributions. / Bonomo, Silvia; Jørgensen, Flemming Steen; Olsen, Lars.

    In: Chemistry: A European Journal, Vol. 23, No. 12, 24.02.2017, p. 2884-2893.

    Research output: Contribution to journalJournal articleResearchpeer-review

  45. Published

    Disulfide conformational analysis. The nature of the S-S rotation barrier1 1 Organo-Sulphur Mechanisms-9. For Part 8 see L. Carlsen and J.P. Snyder, J. Org. Chem. 43, 2216 (1978). / Jørgensen, Flemming S.; Snyder, James P.

    In: Tetrahedron, Vol. 35, No. 11, 01.01.1979, p. 1399-1407.

    Research output: Contribution to journalJournal articleResearchpeer-review

  46. Published

    Docking and scoring of metallo-beta-lactamases inhibitors. / Olsen, Lars; Pettersson, Ingrid; Hemmingsen, Lars; Adolph, Hans-Werner; Jørgensen, Flemming Steen.

    In: Journal of Computer - Aided Molecular Design, Vol. 18, No. 4, 2004, p. 287-302.

    Research output: Contribution to journalJournal articleResearchpeer-review

  47. Published

    Enantioselective endocrine disrupting effects of omeprazole studied in the H295R cell assay and by molecular modeling. / Sørensen, Amalie Møller; Hansen, Cecilie Hurup; Bonomo, Silvia; Olsen, Lars; Jørgensen, Flemming Steen; Weisser, Johan Juhl; Kretschmann, Andreas Christopher; Styrishave, Bjarne.

    In: Toxicology in Vitro, Vol. 34, 19.03.2016, p. 71-80.

    Research output: Contribution to journalJournal articleResearchpeer-review

  48. Published

    Evaluation and comparison of 3D-QSAR CoMSIA models for CDK1, CDK5, and GSK-3 inhibition by paullones. / Kunick, Conrad; Lauenroth, Kathrin; Wieking, Karen; Xie, Xu; Schultz, Christiane; Gussio, Rick; Zaharevitz, Daniel; Leost, Maryse; Meijer, Laurent; Weber, Alexander; Jørgensen, Flemming Steen; Lemcke, Thomas.

    In: Journal of Medicinal Chemistry, Vol. 47, No. 1, 2004, p. 22-36.

    Research output: Contribution to journalJournal articleResearchpeer-review

  49. Published

    Excitatory amino acid receptors: multiplicity and structural requirements for activation and blockade. / Krogsgaard-Larsen, P; Lund, Trine Meldgaard; Jorgensen, FS; Brehn, L.

    Excitatory amino acids and synaptic function. ed. / H Wheal; A Thomson. London : Academic Press, 1991. p. 1-17 (Excitatory Amino Acids and Synaptic Transmission, Academic Press, London).

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  50. Published

    Fast Methods for Prediction of Aldehyde Oxidase-Mediated Site-of-Metabolism. / Montefiori, Marco; Lyngholm-Kjærby, Casper; Long, Anthony; Olsen, Lars; Jørgensen, Flemming Steen.

    In: Computational and Structural Biotechnology Journal, Vol. 17, 01.01.2019, p. 345-351.

    Research output: Contribution to journalJournal articleResearchpeer-review

Previous 1 2 3 Next

ID: 1302104