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ORCIDFlemming Steen Jørgensen
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2010 – 2019
- 2019
[j13]Lars Olsen, Marco Montefiori
, Khanhvi Phuc Tran, Flemming Steen Jørgensen:
SMARTCyp 3.0: enhanced cytochrome P450 site-of-metabolism prediction server. Bioinform. 35(17): 3174-3175 (2019)- [j12]Rasmus Leth, Bogac Ercig, Lars Olsen, Flemming Steen Jørgensen:
Both Reactivity and Accessibility Are Important in Cytochrome P450 Metabolism: A Combined DFT and MD Study of Fenamic Acids in BM3 Mutants. J. Chem. Inf. Model. 59(2): 743-753 (2019) - 2017
- [j11]Silvia Bonomo, Flemming Steen Jørgensen, Lars Olsen:
Mechanism of Cytochrome P450 17A1-Catalyzed Hydroxylase and Lyase Reactions. J. Chem. Inf. Model. 57(5): 1123-1133 (2017) - 2015
- [j10]Rasmus Leth, Patrik Rydberg, Flemming Steen Jørgensen, Lars Olsen:
Density Functional Theory Study on the Formation of Reactive Benzoquinone Imines by Hydrogen Abstraction. J. Chem. Inf. Model. 55(3): 660-666 (2015) - 2012
- [j9]Jacob Poehlsgaard, Kasper Harpsøe, Flemming Steen Jørgensen, Lars Olsen:
A Robust Force Field Based Method for Calculating Conformational Energies of Charged Drug-Like Molecules. J. Chem. Inf. Model. 52(2): 409-419 (2012) - 2011
- [j8]Vignir Ísberg, Thomas Balle, Tommy Sander, Flemming Steen Jørgensen, David E. Gloriam:
G Protein- and Agonist-Bound Serotonin 5-HT2A Receptor Model Activated by Steered Molecular Dynamics Simulations. J. Chem. Inf. Model. 51(2): 315-325 (2011)
2000 – 2009
- 2009
- [j7]Poongavanam Vasanthanathan, Jozef Hritz, Olivier Taboureau, Lars Olsen, Flemming Steen Jørgensen, Nico P. E. Vermeulen, Chris Oostenbrink:
Virtual Screening and Prediction of Site of Metabolism for Cytochrome P450 1A2 Ligands. J. Chem. Inf. Model. 49(1): 43-52 (2009) - 2008
- [j6]Simon Birksø Larsen, Flemming Steen Jørgensen, Lars Olsen:
QSAR Models for the Human H+/Peptide Symporter, hPEPT1: Affinity Prediction Using Alignment-Independent Descriptors. J. Chem. Inf. Model. 48(1): 233-241 (2008) - 2006
- [j5]Niclas Tue Hansen, Irene Kouskoumvekaki, Flemming Steen Jørgensen, Søren Brunak, Svava Ósk Jónsdóttir:
Prediction of pH-Dependent Aqueous Solubility of Druglike Molecules. J. Chem. Inf. Model. 46(6): 2601-2609 (2006) - 2005
- [j4]Svava Ósk Jónsdóttir, Flemming Steen Jørgensen, Søren Brunak:
Prediction methods and databases within chemoinformatics: emphasis on drugs and drug candidates. Bioinform. 21(10): 2145-2160 (2005) - 2004
- [j3]Lars Olsen, Ingrid Pettersson, Lars Hemmingsen, Hans-Werner Adolph, Flemming Steen Jørgensen:
Docking and scoring of metallo-β-lactamases inhibitors. J. Comput. Aided Mol. Des. 18(4): 287-302 (2004)
1990 – 1999
- 1997
- [j2]Inge Thøger Christensen, Flemming Steen Jørgensen:
Conformational analysis of six- and twelve-membered ring compounds by molecular dynamics. J. Comput. Aided Mol. Des. 11(4): 385-394 (1997)
1980 – 1989
- 1987
- [j1]Jette R. Byberg, Flemming Steen Jørgensen, Per D. Klemmensen:
Towards an identification of the pyrethroid pharmacophore. A molecular modelling study of some pyrethroid esters. J. Comput. Aided Mol. Des. 1(3): 181-195 (1987)
Coauthor Index
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