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Origin-independent calculation of quadrupole intensities in X-ray spectroscopy

The Journal of chemical physics, 2012-11, Vol.137 (20), p.204106-204106

2012

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Structural snapshots of the SCR reaction mechanism on Cu-SSZ-13

Chemical communications (Cambridge, England), 2015-06, Vol.51 (44), p.9227-9230

2015

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Designing Safer CRISPR/Cas9 Therapeutics for HIV: Defining Factors That Regulate and Technologies Used to Detect Off-Target Editing

Frontiers in microbiology, 2020-08, Vol.11, p.1872-1872

2020

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Safe CRISPR-Cas9 Inhibition of HIV-1 with High Specificity and Broad-Spectrum Activity by Targeting LTR NF-κB Binding Sites

Molecular therapy. Nucleic acids, 2020-09, Vol.21, p.965-982

2020

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The Influence of the Electronic Structure Method on Intersystem Crossing Dynamics. The Case of Thioformaldehyde

Journal of chemical theory and computation, 2019-06, Vol.15 (6), p.3470-3480

2019

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Assessing Excited State Energy Gaps with Time-Dependent Density Functional Theory on Ru(II) Complexes

Journal of chemical theory and computation, 2017-09, Vol.13 (9), p.4123-4145

2017

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High-resolution X-ray absorption spectroscopy of iron carbonyl complexes

Physical chemistry chemical physics : PCCP, 2015-06, Vol.17 (21), p.13937-13948

2015

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The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes

Physical chemistry chemical physics : PCCP, 2013-06, Vol.15 (21), p.8095

2013

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Selective Catalytic Reduction of NO Over Fe-ZSM-5: Mechanistic Insights by Operando HERFD-XANES and Valence-to-Core X‑ray Emission Spectroscopy

Journal of the American Chemical Society, 2014-09, Vol.136 (37), p.13006-13015

2014

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HIV-1 cure strategies: why CRISPR?

Expert opinion on biological therapy, 2021-06, Vol.21 (6), p.781-793

2021

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Trajectory Surface-Hopping Dynamics Including Intersystem Crossing in [Ru(bpy)3]2

The journal of physical chemistry letters, 2017-08, Vol.8 (16), p.3840-3845

2017

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Probing the Electronic Structure of Substituted Ferrocenes with High-Resolution XANES Spectroscopy

Chemistry : a European journal, 2012-06, Vol.18 (23), p.7021-7025

2012

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Schiff-base compartmental macrocyclic complexes

Chemical communications (Cambridge, England), 1996 (4), p.457-464

1996

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Synthesis and structure of mononuclear and binuclear zinc(ii) compartmental macrocyclic complexes

Dalton transactions : an international journal of inorganic chemistry, 2003-04 (9), p.1730-1737

2003

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Ni(III) vs. Ni(II)-thiyl radical: charge-delocalisation in a binuclear Ni(III)Ni(II)-dithiolate complex

Chemical communications (Cambridge, England), 2003-05 (9), p.1098-1099

2003

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High-resolution X-ray absorption spectroscopy of iron carbonyl complexesElectronic supplementary information (ESI) available: Additional calculated X-ray absorption spectra. See DOI: 10.1039/c5cp01045d

2015-05

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The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenesElectronic supplementary information (ESI) available. See DOI: 10.1039/c3cp50999k

2013-05

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The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenest

Physical chemistry chemical physics : PCCP, 2013, Vol.15 (21), p.8095-8105

2013

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Structural snapshots of the SCR reaction mechanism on Cu-SSZ-13Electronic supplementary information (ESI) available: Experimental details, synthesis, catalytic performance, EXAFS, DFT calculations. See DOI: 10.1039/c5cc01758k

2015-05

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Theoretical x-ray spectroscopy of iron complexes

Atkins, Andrew J

2013

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Studies on transition metal macrocyclic complexes

Atkins, Andrew J

1993

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Synthesis of binuclear platinum metal N 4 O 2 -compartmental complexes: the structures of the protonated metal-free macrocycle [LH 4 ](PF 6 ) 2 ·MeNO 2 and of [Pd 2 (L)](BF 4 ) 2 ·2MeNO 2

Journal of the Chemical Society. Chemical communications, 1993 (4), p.353-355

1993

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Polynuclear nickel( II ) complexes of N 4 O 2 - and N 4 S 2 -compartmental macrocycles: the structures of a Ni 4 O 4 cubane cluster and the binuclear nickel( II ) complex of a benzenethiolate macrocycle

Journal of the Chemical Society. Chemical communications, 1993 (21), p.1662-1665

1993

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Engineering nanoscale order into a designed protein fiber

Proceedings of the National Academy of Sciences - PNAS, 2007-06, Vol.104 (26), p.10853-10858

2007

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Outcomes After Tracheostomy in COVID-19 Patients

Annals of surgery, 2020-09, Vol.272 (3), p.e181

2020

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Origin-independent calculation of quadrupole intensities in X-ray spectroscopy

Structural snapshots of the SCR reaction mechanism on Cu-SSZ-13

Designing Safer CRISPR/Cas9 Therapeutics for HIV: Defining Factors That Regulate and Technologies Used to Detect Off-Target Editing

Safe CRISPR-Cas9 Inhibition of HIV-1 with High Specificity and Broad-Spectrum Activity by Targeting LTR NF-κB Binding Sites

The Influence of the Electronic Structure Method on Intersystem Crossing Dynamics. The Case of Thioformaldehyde

Assessing Excited State Energy Gaps with Time-Dependent Density Functional Theory on Ru(II) Complexes

High-resolution X-ray absorption spectroscopy of iron carbonyl complexes

The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes

Selective Catalytic Reduction of NO Over Fe-ZSM-5: Mechanistic Insights by Operando HERFD-XANES and Valence-to-Core X‑ray Emission Spectroscopy

HIV-1 cure strategies: why CRISPR?

Trajectory Surface-Hopping Dynamics Including Intersystem Crossing in [Ru(bpy)3]2

Probing the Electronic Structure of Substituted Ferrocenes with High-Resolution XANES Spectroscopy

Schiff-base compartmental macrocyclic complexes

Synthesis and structure of mononuclear and binuclear zinc(ii) compartmental macrocyclic complexes

Ni(III) vs. Ni(II)-thiyl radical: charge-delocalisation in a binuclear Ni(III)Ni(II)-dithiolate complex

High-resolution X-ray absorption spectroscopy of iron carbonyl complexesElectronic supplementary information (ESI) available: Additional calculated X-ray absorption spectra. See DOI: 10.1039/c5cp01045d

The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenesElectronic supplementary information (ESI) available. See DOI: 10.1039/c3cp50999k

The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenest

Structural snapshots of the SCR reaction mechanism on Cu-SSZ-13Electronic supplementary information (ESI) available: Experimental details, synthesis, catalytic performance, EXAFS, DFT calculations. See DOI: 10.1039/c5cc01758k

Theoretical x-ray spectroscopy of iron complexes

Studies on transition metal macrocyclic complexes

Synthesis of binuclear platinum metal N 4 O 2 -compartmental complexes: the structures of the protonated metal-free macrocycle [LH 4 ](PF 6 ) 2 ·MeNO 2 and of [Pd 2 (L)](BF 4 ) 2 ·2MeNO 2

Polynuclear nickel( II ) complexes of N 4 O 2 - and N 4 S 2 -compartmental macrocycles: the structures of a Ni 4 O 4 cubane cluster and the binuclear nickel( II ) complex of a benzenethiolate macrocycle

Engineering nanoscale order into a designed protein fiber

Outcomes After Tracheostomy in COVID-19 Patients

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