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Ab Initio Electronic, Magnetic, and Optical Properties of Fe Phthalocyanine on Cr2O3(0001)

Molecules (Basel, Switzerland), 2024-06, Vol.29 (12), p.2889

2024

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Ab Initio Spectroscopic Investigation of Pharmacologically Relevant Chiral Molecules: The Cases of Avibactam, Cephems, and Idelalisib as Benchmarks for Antibiotics and Anticancer Drugs

Symmetry (Basel), 2021-04, Vol.13 (4), p.601

2021

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Metallochaperones and metal-transporting ATPases: a comparative analysis of sequences and structures

Genome research, 2002-02, Vol.12 (2), p.255-271

2002

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Molecular Dynamics Study of the Cu2+ Binding-Induced “Structuring” of the N-Terminal Domain of Human Prion Protein

The journal of physical chemistry. B, 2009-03, Vol.113 (11), p.3277-3279

2009

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Ab Initio Electronic, Magnetic, and Optical Properties of Fe Phthalocyanine on Cr[sub.2]O[sub.3]

Molecules (Basel, Switzerland), 2024-06, Vol.29 (12)

2024

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Ab-initio electronic, magnetic, and optical properties of Fe-phthalocyanine on NiO(001)

Inorganica Chimica Acta, 2024-03, Vol.562, p.121877, Article 121877

2024

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Eumelanin Adsorption on Silicon: Optical Properties of Si(001)-Adsorbed Eumelanin Tetrameric Protomolecules

Journal of physical chemistry. C, 2020-04, Vol.124 (17), p.9376-9384

2020

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Ab initio circular dichroism with the Yambo code: applications to dipeptides

IOP conference series. Materials Science and Engineering, 2022-11, Vol.1265 (1), p.12005

2022

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Extensive stacking of DHI-like monomers as a model of out-of-plane complexity in eumelanin protomolecules: Chemical and structural sensitivity of optical absorption spectra

Chemical physics, 2019-08, Vol.524, p.92-100

2019

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Electronic structure of uracil-like nucleobases adsorbed on Si(001): uracil, thymine and 5-fluorouracil

The European physical journal. B, Condensed matter physics, 2016-04, Vol.89 (4), p.1-9, Article 98

2016

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Self‐Assembled Monolayers of N‐Heterocyclic Olefins on Au(111)

Angewandte Chemie International Edition, 2023-11, Vol.62 (46), p.e202311832-n/a

International ed. in English, 2023

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Optical Properties of Free and Si(001)‐Adsorbed Pyrimidinic Nucleobases

physica status solidi (b), 2018-04, Vol.255 (4), p.n/a

2018

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Fragmentation and charge transfer in cyclic dipeptides with an aromatic side chain induced by VUV radiation

Journal of physics. B, Atomic, molecular, and optical physics, 2024-05, Vol.57 (10), p.105401

2024

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A systematic study of the valence electronic structure of cyclo(Gly-Phe), cyclo(Trp-Tyr) and cyclo(Trp-Trp) dipeptides in the gas phase

Physical chemistry chemical physics : PCCP, 2021-12, Vol.23 (47), p.26793-2685

2021

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NMR Studies of the Zn2+ Interactions with Rat and Human β-Amyloid (1−28) Peptides in Water-Micelle Environment

The journal of physical chemistry. B, 2008-01, Vol.112 (1), p.100-109

2008

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Structural features of the Cu( ii ) complex with the rat Aβ(1–28) fragment

Chemical communications (Cambridge, England), 2008 (3), p.341-343

2008

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Enhancement of Magnetic Stability in Antiferromagnetic CoO Films by Adsorption of Organic Molecules

ACS applied electronic materials, 2024-05, Vol.6 (5), p.3138-3146

2024

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Interaction Of The Human Prion PrP(106−126) Sequence With Copper(II), Manganese(II), And Zinc(II): NMR and EPR Studies

Journal of the American Chemical Society, 2005-01, Vol.127 (3), p.996-1006

2005

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Optical properties of organically functionalized silicon surfaces: Uracil-like nucleobases on Si(001)

Physical review. B, 2017-02, Vol.95 (7), Article 075437

2017

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Self‐Assembled Monolayers of N‐Heterocyclic Olefins on Au(111)

Angewandte Chemie, 2023-11, Vol.135 (46), p.n/a

2023

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Solution Structures of Cyclosporin A and Its Complex with Dysprosium(III) in SDS Micelles: NMR and Molecular Dynamics Studies

The journal of physical chemistry. B, 2008-01, Vol.112 (3), p.828-835

2008

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Molecular Dynamics Study of the Cu 2+ Binding-Induced “Structuring” of the N-Terminal Domain of Human Prion Protein

The journal of physical chemistry. B, 2009-03, Vol.113 (11), p.3277-3279

2009

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Heteronuclear and Homonuclear Cu2+ and Zn2+ Complexes with Multihistidine Peptides Based on Zebrafish Prion-like Protein

Inorganic chemistry, 2009-08, Vol.48 (15), p.7330-7340

2009

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Solution Structures of Cyclosporin A and Its Complex with Dysprosium(III) in SDS Micelles: NMR and Molecular Dynamics Studies

The journal of physical chemistry. B, 2008-01, Vol.112 (3), p.828-835

2008

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Structural Features of Apramycin Bound at the Bacterial Ribosome A Site as Detected by NMR and CD Spectroscopy

Chembiochem : a European journal of chemical biology, 2010-01, Vol.11 (2), p.166-169

2010

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Ab Initio Electronic, Magnetic, and Optical Properties of Fe Phthalocyanine on Cr2O3(0001)

Ab Initio Spectroscopic Investigation of Pharmacologically Relevant Chiral Molecules: The Cases of Avibactam, Cephems, and Idelalisib as Benchmarks for Antibiotics and Anticancer Drugs

Metallochaperones and metal-transporting ATPases: a comparative analysis of sequences and structures

Molecular Dynamics Study of the Cu2+ Binding-Induced “Structuring” of the N-Terminal Domain of Human Prion Protein

Ab Initio Electronic, Magnetic, and Optical Properties of Fe Phthalocyanine on Cr[sub.2]O[sub.3]

Ab-initio electronic, magnetic, and optical properties of Fe-phthalocyanine on NiO(001)

Eumelanin Adsorption on Silicon: Optical Properties of Si(001)-Adsorbed Eumelanin Tetrameric Protomolecules

Ab initio circular dichroism with the Yambo code: applications to dipeptides

Extensive stacking of DHI-like monomers as a model of out-of-plane complexity in eumelanin protomolecules: Chemical and structural sensitivity of optical absorption spectra

Electronic structure of uracil-like nucleobases adsorbed on Si(001): uracil, thymine and 5-fluorouracil

Self‐Assembled Monolayers of N‐Heterocyclic Olefins on Au(111)

Optical Properties of Free and Si(001)‐Adsorbed Pyrimidinic Nucleobases

Fragmentation and charge transfer in cyclic dipeptides with an aromatic side chain induced by VUV radiation

A systematic study of the valence electronic structure of cyclo(Gly-Phe), cyclo(Trp-Tyr) and cyclo(Trp-Trp) dipeptides in the gas phase

NMR Studies of the Zn2+ Interactions with Rat and Human β-Amyloid (1−28) Peptides in Water-Micelle Environment

Structural features of the Cu( ii ) complex with the rat Aβ(1–28) fragment

Enhancement of Magnetic Stability in Antiferromagnetic CoO Films by Adsorption of Organic Molecules

Interaction Of The Human Prion PrP(106−126) Sequence With Copper(II), Manganese(II), And Zinc(II): NMR and EPR Studies

Optical properties of organically functionalized silicon surfaces: Uracil-like nucleobases on Si(001)

Self‐Assembled Monolayers of N‐Heterocyclic Olefins on Au(111)

Solution Structures of Cyclosporin A and Its Complex with Dysprosium(III) in SDS Micelles: NMR and Molecular Dynamics Studies

Molecular Dynamics Study of the Cu 2+ Binding-Induced “Structuring” of the N-Terminal Domain of Human Prion Protein

Heteronuclear and Homonuclear Cu2+ and Zn2+ Complexes with Multihistidine Peptides Based on Zebrafish Prion-like Protein

Solution Structures of Cyclosporin A and Its Complex with Dysprosium(III) in SDS Micelles: NMR and Molecular Dynamics Studies

Structural Features of Apramycin Bound at the Bacterial Ribosome A Site as Detected by NMR and CD Spectroscopy

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