208 related articles for article (PubMed ID: 30354152)
1. Protonation and Reduction of the FeMo Cluster in Nitrogenase Studied by Quantum Mechanics/Molecular Mechanics (QM/MM) Calculations.
Cao L; Caldararu O; Ryde U
J Chem Theory Comput; 2018 Dec; 14(12):6653-6678. PubMed ID: 30354152
[TBL] [Abstract][Full Text] [Related]
2. N
Jiang H; Ryde U
Dalton Trans; 2023 Jul; 52(26):9104-9120. PubMed ID: 37338432
[TBL] [Abstract][Full Text] [Related]
3. Quantum Mechanical Calculations of Redox Potentials of the Metal Clusters in Nitrogenase.
Jiang H; Svensson OKG; Ryde U
Molecules; 2022 Dec; 28(1):. PubMed ID: 36615260
[TBL] [Abstract][Full Text] [Related]
4. QM/MM Study of Partial Dissociation of S2B for the E
Jiang H; Svensson OKG; Ryde U
Inorg Chem; 2022 Nov; 61(45):18067-18076. PubMed ID: 36306385
[TBL] [Abstract][Full Text] [Related]
5. N
Cao L; Ryde U
J Biol Inorg Chem; 2020 May; 25(3):521-540. PubMed ID: 32266560
[TBL] [Abstract][Full Text] [Related]
6. H
Jiang H; Ryde U
Phys Chem Chem Phys; 2024 Jan; 26(2):1364-1375. PubMed ID: 38108422
[TBL] [Abstract][Full Text] [Related]
7. Geometry and Electronic Structure of the P-Cluster in Nitrogenase Studied by Combined Quantum Mechanical and Molecular Mechanical Calculations and Quantum Refinement.
Cao L; Börner MC; Bergmann J; Caldararu O; Ryde U
Inorg Chem; 2019 Aug; 58(15):9672-9690. PubMed ID: 31282663
[TBL] [Abstract][Full Text] [Related]
8. Understanding the Electronic Structure Basis for N
Pang Y; Bjornsson R
Inorg Chem; 2023 Apr; 62(14):5357-5375. PubMed ID: 36988551
[TBL] [Abstract][Full Text] [Related]
9. A conformational equilibrium in the nitrogenase MoFe protein with an α-V70I amino acid substitution illuminates the mechanism of H
Lukoyanov DA; Yang ZY; Shisler K; Peters JW; Raugei S; Dean DR; Seefeldt LC; Hoffman BM
Faraday Discuss; 2023 Jul; 243(0):231-252. PubMed ID: 37021412
[TBL] [Abstract][Full Text] [Related]
10. What Is the Structure of the E
Cao L; Ryde U
J Chem Theory Comput; 2020 Mar; 16(3):1936-1952. PubMed ID: 32003999
[TBL] [Abstract][Full Text] [Related]
11. Protonation States of Homocitrate and Nearby Residues in Nitrogenase Studied by Computational Methods and Quantum Refinement.
Cao L; Caldararu O; Ryde U
J Phys Chem B; 2017 Sep; 121(35):8242-8262. PubMed ID: 28783353
[TBL] [Abstract][Full Text] [Related]
12. Protonation of Homocitrate and the E
Jiang H; Lundgren KJM; Ryde U
Inorg Chem; 2023 Dec; 62(48):19433-19445. PubMed ID: 37987624
[TBL] [Abstract][Full Text] [Related]
13. Exploring the interstitial atom in the FeMo cofactor of nitrogenase: insights from QM and QM/MM calculations.
Xie H; Wu R; Zhou Z; Cao Z
J Phys Chem B; 2008 Sep; 112(36):11435-9. PubMed ID: 18707166
[TBL] [Abstract][Full Text] [Related]
14. Extremely large differences in DFT energies for nitrogenase models.
Cao L; Ryde U
Phys Chem Chem Phys; 2019 Jan; 21(5):2480-2488. PubMed ID: 30652711
[TBL] [Abstract][Full Text] [Related]
15. New insights into the reaction capabilities of His
Dance I
J Inorg Biochem; 2017 Apr; 169():32-43. PubMed ID: 28104568
[TBL] [Abstract][Full Text] [Related]
16. A model for dinitrogen binding in the E
Thorhallsson AT; Benediktsson B; Bjornsson R
Chem Sci; 2019 Dec; 10(48):11110-11124. PubMed ID: 32206260
[TBL] [Abstract][Full Text] [Related]
17. Structures and reaction dynamics of N
Dance I
Dalton Trans; 2021 Dec; 50(48):18212-18237. PubMed ID: 34860237
[TBL] [Abstract][Full Text] [Related]
18. Proton Transfer Pathways in Nitrogenase with and without Dissociated S2B.
Jiang H; Svensson OKG; Cao L; Ryde U
Angew Chem Int Ed Engl; 2022 Sep; 61(39):e202208544. PubMed ID: 35920055
[TBL] [Abstract][Full Text] [Related]
19. How feasible is the reversible S-dissociation mechanism for the activation of FeMo-co, the catalytic site of nitrogenase?
Dance I
Dalton Trans; 2019 Jan; 48(4):1251-1262. PubMed ID: 30607401
[TBL] [Abstract][Full Text] [Related]
20. Thermodynamically Favourable States in the Reaction of Nitrogenase without Dissociation of any Sulfide Ligand.
Jiang H; Ryde U
Chemistry; 2022 Mar; 28(14):e202103933. PubMed ID: 35006641
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]