UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

Quantum Mechanics/Molecular Mechanics Modeling of Enzymatic Processes: Caveats and Breakthroughs

Chemistry : a European journal, 2016-02, Vol.22 (8), p.2562-2581

2016

Volltextzugriff (PDF)

Origin of the Regioselective Fatty-Acid Hydroxylation versus Decarboxylation by a Cytochrome P450 Peroxygenase: What Drives the Reaction to Biofuel Production?

Chemistry : a European journal, 2016-04, Vol.22 (16), p.5478-5483

2016

Volltextzugriff (PDF)

Singlet versus Triplet Reactivity in an Mn(V)–Oxo Species: Testing Theoretical Predictions Against Experimental Evidence

Journal of the American Chemical Society, 2016-09, Vol.138 (38), p.12375-12386

2016

Volltextzugriff (PDF)

Hydrogen-Bonding Interactions Trigger a Spin-Flip in Iron(III) Porphyrin Complexes

Angewandte Chemie International Edition, 2015-04, Vol.54 (16), p.4796-4800

International ed. in English, 2015

Volltextzugriff (PDF)

Quantum Mechanics/Molecular Mechanics Study on the Oxygen Binding and Substrate Hydroxylation Step in AlkB Repair Enzymes

Chemistry : a European journal, 2014-01, Vol.20 (2), p.435-446

2014

Volltextzugriff (PDF)

Secondary Coordination Sphere Influence on the Reactivity of Nonheme Iron(II) Complexes: An Experimental and DFT Approach

Journal of the American Chemical Society, 2013-07, Vol.135 (29), p.10590-10593

2013

Volltextzugriff (PDF)

Oxygen-Atom Transfer Reactivity of Axially Ligated Mn(V)–Oxo Complexes: Evidence for Enhanced Electrophilic and Nucleophilic Pathways

Journal of the American Chemical Society, 2014-10, Vol.136 (39), p.13845-13852

2014

Volltextzugriff (PDF)

Advances in Sustainable Catalysis: A Computational Perspective

Frontiers in chemistry, 2019-04, Vol.7, p.182

2019

Volltextzugriff (PDF)

Prospective survey of acute osteoarticular infections in a French paediatric orthopedic surgery unit

Clinical microbiology and infection, 2013-09, Vol.19 (9), p.822-828

2013

Volltextzugriff (PDF)

Matrix‐assisted laser desorption ionization time‐of‐flight mass spectrometry for fast and accurate identification of clinically relevant Aspergillus species

Clinical microbiology and infection, 2011-05, Vol.17 (5), p.750-755

2011

Volltextzugriff (PDF)

Experimental and Computational Evidence for the Mechanism of Intradiol Catechol Dioxygenation by Non-Heme Iron(III) Complexes

Chemistry : a European journal, 2014-11, Vol.20 (48), p.15686-15691

2014

Volltextzugriff (PDF)

Microbiological Diagnosis of Empyema in Children: Comparative Evaluations by Culture, Polymerase Chain Reaction, and Pneumococcal Antigen Detection in Pleural Fluids

Clinical infectious diseases, 2006-04, Vol.42 (8), p.1135-1140

2006

Volltextzugriff (PDF)

Rapid and Accurate Species-Level Identification of Coagulase-Negative Staphylococci by Using the sodA Gene as a Target

Journal of Clinical Microbiology, 2001-12, Vol.39 (12), p.4296-4301

2001

Volltextzugriff (PDF)

Mechanism of CO conversion to methanol over Cu(110) and Cu(100) surfaces

Dalton transactions : an international journal of inorganic chemistry, 2020-07, Vol.49 (25), p.8478-8497

2020

Volltextzugriff (PDF)

Bulk and surface properties of metal carbides: implications for catalysis

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (10), p.6905-6916

2018

Volltextzugriff (PDF)

Computational modelling of oxygenation processes in enzymes and biomimetic model complexes

Chemical communications (Cambridge, England), 2014-01, Vol.5 (3), p.262-282

2014

Volltextzugriff (PDF)

Computational modelling in catalytic science

Physical chemistry chemical physics : PCCP, 2023-08, Vol.25 (31), p.2775-2776

2023

Volltextzugriff (PDF)

Matrix-assisted laser desorption ionization-time of flight mass spectrometry for fast and accurate identification of Pseudallescheria/ Scedosporium species

Clinical microbiology and infection, 2014-09, Vol.20 (9), p.929-935

2014

Volltextzugriff (PDF)

A Noncanonical Tryptophan Analogue Reveals an Active Site Hydrogen Bond Controlling Ferryl Reactivity in a Heme Peroxidase

JACS Au, 2021-07, Vol.1 (7), p.913-918

2021

Volltextzugriff (PDF)

Hydrogen adsorption on transition metal carbides: a DFT study

Physical chemistry chemical physics : PCCP, 2019-03, Vol.21 (10), p.5335-5343

2019

Volltextzugriff (PDF)

Modelling the bulk properties of ambient pressure polymorphs of zirconia

Physical chemistry chemical physics : PCCP, 2020-03, Vol.22 (12), p.666-6676

2020

Volltextzugriff (PDF)

Group Transfer to an Aliphatic Bond: A Biomimetic Study Inspired by Nonheme Iron Halogenases

ACS catalysis, 2018-09, Vol.8 (9), p.8685-8698

2018

Volltextzugriff (PDF)

Overview on theoretical studies discriminating the two-oxidant versus two-state-reactivity models for substrate monoxygenation by cytochrome P450 enzymes

Current topics in medicinal chemistry, 2013-09, Vol.13 (18), p.2218-2232

2013

Volltextzugriff (PDF)

Carbon dioxide and water co-adsorption on the low-index surfaces of TiC, VC, ZrC and NbC: a DFT study

Physical chemistry chemical physics : PCCP, 2019-05, Vol.21 (2), p.175-176

2019

Volltextzugriff (PDF)

Origin of the Enhanced Reactivity of μ‑Nitrido-Bridged Diiron(IV)-Oxo Porphyrinoid Complexes over Cytochrome P450 Compound I

ACS catalysis, 2016-04, Vol.6 (4), p.2230-2243

2016

Volltextzugriff (PDF)

1 – 25 von 227

Suche als RSS-Feed

Aktive Filter

ThemaAged

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(208)
Mit Volltextzugriff
(181)

Publikationsform

Sprache

Erscheinungsjahr

n.n

Thema

Science & Technology
(130)
Life Sciences & Biomedicine
(76)
Humans
(61)
Chemistry
(50)
Physical Sciences
(50)
Male
(24)
Biological And Medical Sciences
(23)
Female
(23)
Chemistry, Multidisciplinary
(22)
Medical Sciences
(19)
Microbiology
(17)
Infectious Diseases
(16)
Chemistry, Physical
(15)
Child
(13)
Lung Cancer
(13)
Tumors
(13)
Hydroxylation
(12)
Biochemistry & Molecular Biology
(11)
Mutation
(11)
Science & Technology - Other Topics
(11)

15 weitere anzeigen...

Weniger anzeigen...

Zeitschrift / Serie

5 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

... seit 90 Tagen
(3)

Menü

Weitere Dienste

Einstellungen

Quantum Mechanics/Molecular Mechanics Modeling of Enzymatic Processes: Caveats and Breakthroughs

Origin of the Regioselective Fatty-Acid Hydroxylation versus Decarboxylation by a Cytochrome P450 Peroxygenase: What Drives the Reaction to Biofuel Production?

Singlet versus Triplet Reactivity in an Mn(V)–Oxo Species: Testing Theoretical Predictions Against Experimental Evidence

Hydrogen-Bonding Interactions Trigger a Spin-Flip in Iron(III) Porphyrin Complexes

Quantum Mechanics/Molecular Mechanics Study on the Oxygen Binding and Substrate Hydroxylation Step in AlkB Repair Enzymes

Secondary Coordination Sphere Influence on the Reactivity of Nonheme Iron(II) Complexes: An Experimental and DFT Approach

Oxygen-Atom Transfer Reactivity of Axially Ligated Mn(V)–Oxo Complexes: Evidence for Enhanced Electrophilic and Nucleophilic Pathways

Advances in Sustainable Catalysis: A Computational Perspective

Prospective survey of acute osteoarticular infections in a French paediatric orthopedic surgery unit

Matrix‐assisted laser desorption ionization time‐of‐flight mass spectrometry for fast and accurate identification of clinically relevant Aspergillus species

Experimental and Computational Evidence for the Mechanism of Intradiol Catechol Dioxygenation by Non-Heme Iron(III) Complexes

Microbiological Diagnosis of Empyema in Children: Comparative Evaluations by Culture, Polymerase Chain Reaction, and Pneumococcal Antigen Detection in Pleural Fluids

Rapid and Accurate Species-Level Identification of Coagulase-Negative Staphylococci by Using the sodA Gene as a Target

Mechanism of CO conversion to methanol over Cu(110) and Cu(100) surfaces

Bulk and surface properties of metal carbides: implications for catalysis

Computational modelling of oxygenation processes in enzymes and biomimetic model complexes

Computational modelling in catalytic science

Matrix-assisted laser desorption ionization-time of flight mass spectrometry for fast and accurate identification of Pseudallescheria/ Scedosporium species

A Noncanonical Tryptophan Analogue Reveals an Active Site Hydrogen Bond Controlling Ferryl Reactivity in a Heme Peroxidase

Hydrogen adsorption on transition metal carbides: a DFT study

Modelling the bulk properties of ambient pressure polymorphs of zirconia

Group Transfer to an Aliphatic Bond: A Biomimetic Study Inspired by Nonheme Iron Halogenases

Overview on theoretical studies discriminating the two-oxidant versus two-state-reactivity models for substrate monoxygenation by cytochrome P450 enzymes

Carbon dioxide and water co-adsorption on the low-index surfaces of TiC, VC, ZrC and NbC: a DFT study

Origin of the Enhanced Reactivity of μ‑Nitrido-Bridged Diiron(IV)-Oxo Porphyrinoid Complexes over Cytochrome P450 Compound I

Aktive Filter

Suchergebnisse filtern