Publications of Matthias Stein
All genres
Journal Article (90)
61.
Journal Article
35 (9), pp. 2040 - 2048 (2017)
The signaling pathway of dopamine D2 receptor (D2R) activation using normal mode analysis (NMA) and the construction of pharmacophore models for D2R ligands. Journal of Biomolecular Structure and Dynamics 62.
Journal Article
85 (1), pp. 17 - 29 (2017)
Double Phosphorylation-Induced Structural Changes in the Signal-Receiving Domain of IκBα in Complex with NF-κB. Proteins: Structure, Function, and Bioinformatics 63.
Journal Article
7 (2), pp. 185 - 195 (2016)
Binding Interactions of Dopamine and Apomorphine in D2High and D2Low States of Human Dopamine D2 Receptor Using Computational and Experimental Techniques. ACS Chemical Neuroscience 64.
Journal Article
102, pp. 229 - 237 (2016)
Resolution of Structural Isomers of Complex Reaction Mixtures in Homogeneous Catalysis. Chemical Engineering and Processing 65.
Journal Article
2016 (52), pp. 8309 - 8312 (2016)
Diversity in a simple co-crystal: racemic and kryptoracemic behaviour. Chemical Communications 66.
Journal Article
12 (1), e1004704 (2016)
The Molecular Basis of Polyunsaturated Fatty Acid Interactions with the Shaker Voltage-Gated Potassium Channel. PLoS Computational Biology 67.
Journal Article
137, pp. 768 - 785 (2015)
The thermodynamics and biodegradability of chelating agents upon metal extraction. Chemical Engineering Science 68.
Journal Article
137 (34), pp. 11095 - 11104 (2015)
Are the crystal structures of enantiopure and racemic mandelic acids determined by kinetics or thermodynamics? Journal of the American Chemical Society 69.
Journal Article
119 (26), pp. 6773 - 6780 (2015)
Molecular Reorganization Energy as a Key Determinant of J-Band Formation in J-Aggregates of Polymethine Dyes. The Journal of Physical Chemistry A 70.
Journal Article
119 (43), pp. 3870 - 13882 (2015)
Rates and Routes of Electron Transfer of [NiFe]-Hydrogenase in an Enzymatic Fuel Cell. The Journal of Physical Chemistry B 71.
Journal Article
19 (2), pp. 321 - 332 (2015)
Modeling and protein engineering studies of active and inactive states of human dopamine D2 receptor (D2R) and investigation of drug/receptor interactions. Molecular Diversity 72.
Journal Article
2, 32 (2015)
Structural modeling of the N-terminal signal–receiving domain of IκBα. frontiers in Molecular Biosciences 73.
Journal Article
53 (8), pp. 4243 - 4249 (2014)
NiI/RuII Model for the Ni–L State of the [NiFe]Hydrogenases: Synthesis, Spectroscopy, and Reactivity. Inorganic Chemistry 74.
Journal Article
2014 (22), pp. 3587 - 3599 (2014)
Spin‐State‐Dependent Properties of an Iron(III) Hydrogenase Mimic. European Journal of Inorganic Chemistry 75.
Journal Article
43 (25), pp. 9392 - 9405 (2014)
[NiFe] hydrogenases: how close do structural and functional mimics approach the active site? Dalton Transactions 76.
Journal Article
136 (50), pp. 17366 - 17369 (2014)
Direct Observation of Key Catalytic Intermediates in a Photoinduced Proton Reduction Cycle with a Diiron Carbonyl Complex. Journal of the American Chemical Society 77.
Journal Article
43, pp. 4537 - 4549 (2014)
Coordination and conformational isomers in mononuclear iron complexes with pertinence to the [FeFe] hydrogenase active site. Dalton Transactions 78.
Journal Article
19 (43), pp. 14566 - 14572 (2013)
Effect of Cyanide Ligands on the Electronic Structure of [FeFe] Hydrogenase Active-Site Model Complexes with an Azadithiolate Cofactor. Chemistry – A European Journal 79.
Journal Article
41 (5), pp. 1317 - 1324 (2013)
Microbial hydrogen splitting in the presence of oxygen. Biochemical Society Transactions 80.
Journal Article
135 (9), pp. 3633 - 3639 (2013)
Isolation of a Mixed Valence Diiron Hydride: Evidence for a Spectator Hydride in Hydrogen Evolution Catalysis. Journal of the American Chemical Society