Patrik Rydberg (Former)
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- 2012
-
Mark
Binding affinities in the SAMPL3 trypsin and host-guest blind tests estimated with the MM/PBSA and LIE methods.
Mikulskis, Paulius LU ; Genheden, Samuel LU ; Rydberg, Patrik LU ; Sandberg, Lars ; Olsen, Lars and Ryde, Ulf LU
(2012)
In Journal of Computer-Aided Molecular Design
26(5).
p.527-541
- Contribution to journal › Article
-
Mark
Quantum-mechanical studies of reactions performed by cytochrome P450 enzymes
Rydberg, Patrik LU ; Olsen, Lars and Ryde, Ulf LU
(2012)
In Current Inorganic Chemistry
2.
p.292-315
- Contribution to journal › Scientific review
- 2008
-
Mark
Protonation of the proximal histidine ligand in heme peroxidases.
Heimdal, Jimmy LU ; Rydberg, Patrik LU and Ryde, Ulf LU
(2008)
In The Journal of Physical Chemistry Part B
112(8).
p.2501-2510
- Contribution to journal › Article
-
Mark
A comparison of the tetrapyrrole cofactors in nature and their tuning by axial ligands
- Chapter in Book/Report/Conference proceeding › Book chapter
-
Mark
Transition-state docking of flunitrazepam and progesterone in cytochrome P450
Rydberg, Patrik LU ; Hansen, Sine Myrup ; Kongsted, Jacob LU ; Norrby, Per-Ola ; Olsen, Lars and Ryde, Ulf LU
(2008)
In Journal of Chemical Theory and Computation
4(4).
p.673-681
- Contribution to journal › Article
- 2007
-
Mark
Dynamics of water molecules in the active-site cavity of human cytochromes P450
Rydberg, Patrik LU ; Rod, Thomas LU ; Olsen, Lars and Ryde, Ulf LU
(2007)
In The Journal of Physical Chemistry Part B
111(19).
p.5445-5457
- Contribution to journal › Article
-
Mark
Theoretical Studies of Cytochrome P450
(2007)
- Thesis › Doctoral thesis (compilation)
-
Mark
General transition-state force field for cytochrome p450 Hydroxylation
Rydberg, Patrik LU ; Olsen, Lars ; Norrby, Per-Ola and Ryde, Ulf LU
(2007)
In Journal of Chemical Theory and Computation
3(5).
p.1765-1773
- Contribution to journal › Article
- 2006
-
Mark
Structures of the high-valent metal-ion haem-oxygen intermediates in peroxidases, oxygenases and catalases
Hersleth, HP ; Ryde, Ulf LU
; Rydberg, Patrik
LU
; Gorbitz, CH
and Andersson, KK
(2006)
In Journal of Inorganic Biochemistry
100(4).
p.460-476
- Contribution to journal › Scientific review
-
Mark
Implicit versus explicit solvent in free energy calculations of enzyme catalysis: Methyl transfer catalyzed by catechol O-methyltransferase
- Contribution to journal › Article