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- 2024
-
Mark
Unraveling the Binding Mode of Cyclic Adenosine–Inosine Monophosphate (cAIMP) to STING through Molecular Dynamics Simulations
Wang, Meiting LU ; Fan, Baoyi ; Lu, Wenfeng ; Ryde, Ulf LU
; Chang, Yuxiao
; Han, Di
; Lu, Jiarui
; Liu, Taigang
; Gao, Qinghe
and Chen, Changpo
, et al.
(2024)
In Molecules
29(11).
- Contribution to journal › Article
-
Mark
Putative reaction mechanism of nitrogenase with a half-dissociated S2B ligand
- Contribution to journal › Article
-
Mark
Convergence criteria for single-step free-energy calculations : the relation between the Π bias measure and the sample variance
- Contribution to journal › Article
-
Mark
H2 formation from the E2–E4 states of nitrogenase
- Contribution to journal › Article
-
Mark
CO Oxidation Mechanism of Silver-Substituted Mo/Cu CO-Dehydrogenase – Analogies and Differences to the Native Enzyme
Rovaletti, Anna ; Moro, Giorgio ; Cosentino, Ugo ; Ryde, Ulf LU
and Greco, Claudio
(2024)
In ChemPhysChem
25(13).
- Contribution to journal › Article
-
Mark
Rubus wahlbergii and related species in Sweden
Zhou, Mingyue ; Montes, Melanie S. ; Mattsson, Tore ; Burén, Tomas ; Hedrén, Mikael LU and Ryde, Ulf LU
(2024)
In Nordic Journal of Botany
2024(9).
- Contribution to journal › Article
-
Mark
Quantum refinement in real and reciprocal space using the Phenix and ORCA software
Lundgren, Kristoffer J.M. LU ; Caldararu, Octav LU ; Oksanen, Esko and Ryde, Ulf LU
(2024)
In IUCrJ
11(Pt 6).
p.921-937
- Contribution to journal › Article
-
Mark
Investigating the Substrate Oxidation Mechanism in Lytic Polysaccharide Monooxygenase : H2O2- versus O2-Activation
Hagemann, Marlisa M. LU ; Wieduwilt, Erna K. ; Ryde, Ulf LU
and Hedegård, Erik D.
LU
(2024)
In Inorganic Chemistry
63(46).
p.21929-21940
- Contribution to journal › Article
- 2023
-
Mark
A computational study of the reaction mechanism and stereospecificity of dihydropyrimidinase
Meelua, Wijitra ; Wanjai, Tanchanok ; Thinkumrob, Natechanok ; Oláh, Julianna ; Cairns, James R.Ketudat ; Hannongbua, Supa ; Ryde, Ulf LU
and Jitonnom, Jitrayut
(2023)
In Physical Chemistry Chemical Physics
25(12).
p.8767-8778
- Contribution to journal › Article
-
Mark
Histidine oxidation in lytic polysaccharide monooxygenase
Torbjörnsson, Magne LU ; Hagemann, Marlisa M. LU ; Ryde, Ulf LU
and Hedegård, Erik Donovan
LU
(2023)
In Journal of Biological Inorganic Chemistry
28(3).
p.317-328
- Contribution to journal › Article