Search details
1.
A lysine-cysteine redox switch with an NOS bridge regulates enzyme function.
Nature
; 593(7859): 460-464, 2021 05.
Article
in English
| MEDLINE | ID: mdl-33953398
2.
Dispersion Control over Molecule Cohesion: Exploiting and Dissecting the Tipping Power of Aromatic Rings.
Acc Chem Res
; 57(8): 1077-1086, 2024 Apr 16.
Article
in English
| MEDLINE | ID: mdl-38537179
3.
Low-barrier hydrogen bonds in enzyme cooperativity.
Nature
; 573(7775): 609-613, 2019 09.
Article
in English
| MEDLINE | ID: mdl-31534226
4.
Widespread occurrence of covalent lysine-cysteine redox switches in proteins.
Nat Chem Biol
; 18(4): 368-375, 2022 04.
Article
in English
| MEDLINE | ID: mdl-35165445
5.
Optimization of Quantum Nuclei Positions with the Adaptive Nuclear-Electronic Orbital Approach.
J Phys Chem A
; 128(16): 3205-3211, 2024 Apr 25.
Article
in English
| MEDLINE | ID: mdl-38619054
6.
The Fe-MAN Challenge: Ferrates-Microkinetic Assessment of Numerical Quantum Chemistry.
J Phys Chem A
; 2024 Jun 04.
Article
in English
| MEDLINE | ID: mdl-38832568
7.
N-(Sulfonio)Sulfilimine Reagents: Non-Oxidizing Sources of Electrophilic Nitrogen Atom for Skeletal Editing.
Angew Chem Int Ed Engl
; : e202403826, 2024 Apr 16.
Article
in English
| MEDLINE | ID: mdl-38623698
8.
Automated handling of complex chemical structures in Z-matrix coordinates-The chemcoord library.
J Comput Chem
; 44(5): 710-726, 2023 Feb 15.
Article
in English
| MEDLINE | ID: mdl-36541725
9.
Modulating Secondary Structure Motifs Through Photo-Labile Peptide Staples.
Chembiochem
; 24(16): e202300270, 2023 08 15.
Article
in English
| MEDLINE | ID: mdl-37216330
10.
5-(Trifluorovinyl)dibenzothiophenium Triflate: Introducing the 1,1,2-Trifluoroethylene Tether in Drug-Like Structures.
Chemistry
; 29(18): e202203966, 2023 Mar 28.
Article
in English
| MEDLINE | ID: mdl-36545870
11.
The Catalytic Mechanism of Acetoacetate Decarboxylase: A Detailed Study of Schiff Base Formation, Protonation States, and Their Impact on Catalysis.
J Chem Inf Model
; 63(10): 3118-3127, 2023 05 22.
Article
in English
| MEDLINE | ID: mdl-37127583
12.
Revisiting the origin of the bending in group 2 metallocenes AeCp2 (Ae = Be-Ba).
Phys Chem Chem Phys
; 25(30): 20657-20667, 2023 Aug 02.
Article
in English
| MEDLINE | ID: mdl-37482883
13.
The first HyDRA challenge for computational vibrational spectroscopy.
Phys Chem Chem Phys
; 25(33): 22089-22102, 2023 Aug 23.
Article
in English
| MEDLINE | ID: mdl-37610422
14.
Mechanisms of Cysteine-Lysine Covalent Linkage-The Role of Reactive Oxygen Species and Competition with Disulfide Bonds.
Angew Chem Int Ed Engl
; 62(36): e202304163, 2023 Sep 04.
Article
in English
| MEDLINE | ID: mdl-37294559
15.
Pentafluorocyclopropanation of (Hetero)arenes Using Sulfonium Salts: Applications in Late-Stage Functionalization.
Angew Chem Int Ed Engl
; 62(35): e202306764, 2023 Aug 28.
Article
in English
| MEDLINE | ID: mdl-37402213
16.
Anomeric Stereoauxiliary Cleavage of the C-N Bond of d-Glucosamine for the Preparation of Imidazo[1,5-a]pyridines.
Chemistry
; 28(29): e202200648, 2022 May 19.
Article
in English
| MEDLINE | ID: mdl-35319128
17.
Setting up the HyDRA blind challenge for the microhydration of organic molecules.
Phys Chem Chem Phys
; 24(19): 11442-11454, 2022 May 18.
Article
in English
| MEDLINE | ID: mdl-35522931
18.
Ligand-Enabled Disproportionation of 1,2-Diphenylhydrazine at a PV -Center.
Angew Chem Int Ed Engl
; 61(35): e202207450, 2022 Aug 26.
Article
in English
| MEDLINE | ID: mdl-35714171
19.
Trapping X-ray Radiation Damage from Homolytic Se-C Bond Cleavage in BnSeSeBn Crystals (Bn=benzyl, CH2 C6 H5 ).
Angew Chem Int Ed Engl
; 61(26): e202203665, 2022 Jun 27.
Article
in English
| MEDLINE | ID: mdl-35417063
20.
In-Fjord Substitution in Expanded Helicenes: Effects of the Insert on the Inversion Barrier and Helical Pitch.
Chemistry
; 27(53): 13358-13366, 2021 Sep 20.
Article
in English
| MEDLINE | ID: mdl-34288171