Bruschi M - Search Results

1

H₂ Activation in [FeFe]-Hydrogenase Cofactor Versus Diiron Dithiolate Models: Factors Underlying the Catalytic Success of Nature and Implications for an Improved Biomimicry.

Arrigoni F, Bertini L, Bruschi M, Greco C, De Gioia L, Zampella G. Arrigoni F, et al. Among authors: bruschi m. Chemistry. 2019 Jan 24;25(5):1227-1241. doi: 10.1002/chem.201804687. Epub 2019 Jan 2. Chemistry. 2019. PMID: 30475417

2

Dissecting the intimate mechanism of cyanation of {2Fe3S} complexes related to the active site of all-iron hydrogenases by DFT analysis of energetics, transition states, intermediates and products in the carbonyl substitution pathway.

Zampella G, Bruschi M, Fantucci P, Razavet M, Pickett CJ, De Gioia L. Zampella G, et al. Among authors: bruschi m. Chemistry. 2005 Jan 7;11(2):509-20. doi: 10.1002/chem.200400442. Chemistry. 2005. PMID: 15578644

3

Isocyanide in biochemistry? A theoretical investigation of the electronic effects and energetics of cyanide ligand protonation in [FeFe]-hydrogenases.

Greco C, Bruschi M, Fantucci P, Ryde U, De Gioia L. Greco C, et al. Among authors: bruschi m. Chemistry. 2011 Feb 7;17(6):1954-65. doi: 10.1002/chem.201001493. Epub 2011 Jan 12. Chemistry. 2011. PMID: 21274947

4

DFT investigation of structural, electronic, and catalytic properties of diiron complexes related to the [2Fe](H) subcluster of Fe-only hydrogenases.

Bruschi M, Fantucci P, De Gioia L. Bruschi M, et al. Inorg Chem. 2002 Mar 25;41(6):1421-9. doi: 10.1021/ic010770r. Inorg Chem. 2002. PMID: 11896710

5

DFT Investigation of H2 activation by [M(NHPnPr3)('S3')] (M = Ni, Pd). Insight into key factors relevant to the design of hydrogenase functional models.

Zampella G, Bruschi M, Fantucci P, De Gioia L. Zampella G, et al. Among authors: bruschi m. J Am Chem Soc. 2005 Sep 28;127(38):13180-9. doi: 10.1021/ja0508424. J Am Chem Soc. 2005. PMID: 16173745

6

Insights into the mechanism of electrocatalytic hydrogen evolution mediated by Fe2(S2C3H6)(CO)6: the simplest functional model of the Fe-hydrogenase active site.

Greco C, Zampella G, Bertini L, Bruschi M, Fantucci P, De Gioia L. Greco C, et al. Among authors: bruschi m. Inorg Chem. 2007 Jan 8;46(1):108-16. doi: 10.1021/ic061168+. Inorg Chem. 2007. PMID: 17198418

7

A QM/MM investigation of the activation and catalytic mechanism of Fe-only hydrogenases.

Greco C, Bruschi M, De Gioia L, Ryde U. Greco C, et al. Among authors: bruschi m. Inorg Chem. 2007 Jul 23;46(15):5911-21. doi: 10.1021/ic062320a. Epub 2007 Jun 29. Inorg Chem. 2007. PMID: 17602468

8

Structural insights into the active-ready form of [FeFe]-hydrogenase and mechanistic details of its inhibition by carbon monoxide.

Greco C, Bruschi M, Heimdal J, Fantucci P, De Gioia L, Ryde U. Greco C, et al. Among authors: bruschi m. Inorg Chem. 2007 Sep 3;46(18):7256-8. doi: 10.1021/ic701051h. Epub 2007 Aug 4. Inorg Chem. 2007. PMID: 17676838

9

Structure and energetics of Fe2(CO)8 singlet and triplet electronic states.

Bertini L, Bruschi M, De Gioia L, Fantucci P. Bertini L, et al. Among authors: bruschi m. J Phys Chem A. 2007 Dec 6;111(48):12152-62. doi: 10.1021/jp075343z. Epub 2007 Nov 8. J Phys Chem A. 2007. PMID: 17988105

10

Structural and electronic properties of the [FeFe] hydrogenase H-cluster in different redox and protonation states. A DFT investigation.

Bruschi M, Greco C, Fantucci P, De Gioia L. Bruschi M, et al. Inorg Chem. 2008 Jul 7;47(13):6056-71. doi: 10.1021/ic8006298. Epub 2008 Jun 10. Inorg Chem. 2008. PMID: 18540595

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

840 results

Search Page

Filters