Flemming Steen Jørgensen
Professor
Biostructural Research
Jagtvej 162, 2100 København Ø, 30, Building: 115
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 proceeding › Book chapter › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 proceeding › Book chapter › Education
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- Published
Computeren er medicinalkemikerens arbejdshest. / Larsen, Simon Birksø; Olsen, Lars; Jørgensen, Flemming Steen.
In: Lægemiddelforskning, 2009, p. 7-9.Research output: Contribution to journal › Journal article › Communication
- Published
Computeren kan forudsige lægemidlers omdannelse. / Olsen, Lars; Bergmann, Rikke; Jørgensen, Flemming Steen.
In: Lægemiddelforskning 2004, 2004.Research output: Contribution to journal › Journal article › Research
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
- 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 journal › Journal article › Research › peer-review
ID: 1302104
Most downloads
-
1704
downloads
Forbedret optagelse af lægemidler i organismen: computeren viser vejen
Research output: Contribution to journal › Journal article › Research
Published -
1599
downloads
Synthesis and antiangiogenic activity of N-alkylated levamisole derivatives
Research output: Contribution to journal › Journal article › Research › peer-review
Published -
1265
downloads
Design of prodrugs targeting the intestinal di/tri‐peptide transporter hPEPT1 (SLC15A1
Research output: Contribution to conference › Conference abstract for conference › Research › peer-review
Published