UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Progress in the Theory of X‑ray Spectroscopy: From Quantum Chemistry to Machine Learning and Ultrafast Dynamics

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-05, Vol.125 (20), p.4276-4293

2021

Volltextzugriff (PDF)

A Deep Neural Network for the Rapid Prediction of X‑ray Absorption Spectra

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-05, Vol.124 (21), p.4263-4270

2020

Volltextzugriff (PDF)

Accurate, affordable, and generalizable machine learning simulations of transition metal x-ray absorption spectra using the XANESNET deep neural network

The Journal of chemical physics, 2022-04, Vol.156 (16), p.164102-164102

2022

Volltextzugriff (PDF)

The photochemistry of Rydberg-excited cyclobutanone: Photoinduced processes and ground state dynamics

The Journal of chemical physics, 2024-04, Vol.160 (15)

2024

Volltextzugriff (PDF)

A deep neural network for valence-to-core X-ray emission spectroscopy

Molecular physics, 2023-04, Vol.121 (7-8)

2023

Volltextzugriff (PDF)

Photo-induced structural dynamics of o -nitrophenol by ultrafast electron diffraction

Physical chemistry chemical physics : PCCP, 2024-07, Vol.26 (26), p.17991-17998

2024

Volltextzugriff (PDF)

A theoretical investigation of internal conversion in 1,2-dithiane using non-adiabatic multiconfigurational molecular dynamics

Physical chemistry chemical physics : PCCP, 2016-10, Vol.18 (39), p.27170-27174

2016

Volltextzugriff (PDF)

On the analysis of X-ray absorption spectra for polyoxometallates

Chemical physics letters, 2021-10, Vol.780, p.138893, Article 138893

2021

Volltextzugriff (PDF)

Atmospheric breakdown chemistry of the new “green” solvent 2,2,5,5-tetramethyloxolane via gas-phase reactions with OH and Cl radicals

Atmospheric chemistry and physics, 2022-11, Vol.22 (22), p.14589-14602

2022

Volltextzugriff (PDF)

Photo-induced structural dynamics of -nitrophenol by ultrafast electron diffraction

Physical chemistry chemical physics : PCCP, 2024-07, Vol.26 (26), p.17991-17998

2024

Volltextzugriff (PDF)

A theoretical investigation of internal conversion in 1,2-dithiane using non-adiabatic multiconfigurational molecular dynamicsElectronic supplementary information (ESI) available: Additional computational details, orbitals included in our SA3-CASSCF(10,8) active space (Fig. S1), xyz geometries (Tables S1-S3), LIIC pathways computed at the SA3-CASSCF(10,8) and LS-XMS-CASPT2 levels and supplementary two-dimensional heat-density maps (Fig. S2) characterising the motion reported in this communicatio

2016-10

Volltextzugriff (PDF)

Focal Lesions in the Rat Central Nervous System Induced by Endothelin-1

Journal of neuropathology and experimental neurology, 2003-12, Vol.62 (12), p.1276-1286

2003

Volltextzugriff (PDF)

MCP-1 and murine prion disease: Separation of early behavioural dysfunction from overt clinical disease

Neurobiology of disease, 2005-11, Vol.20 (2), p.283-295

2005

Volltextzugriff (PDF)

Sa1000: DIARRHEA, ELEVATED AST, AND ELEVATION OF INFLAMMATORYRELATED BIOMARKERS IS A PREDICTOR FOR MORTALITY IN MINORITY HOSPITALISED COVID-19 PATIENTS

Gastroenterology (New York, N.Y. 1943), 2022-05, Vol.162 (7), p.S-279-S-279

2022

Volltextzugriff (PDF)

Compression of the dorsalis pedis artery: a novel cause of blue toe syndrome

Vascular, 2012-12, Vol.20 (6), p.325

2012

Volltextzugriff (PDF)

Handbook of Treatment Planning for Children with Autism and Other Neurodevelopmental Disorders

McPherson, Pamela

Volltextzugriff (PDF)

TH-CD-BRA-02: 3D Remote Dosimetry for MRI-Guided Radiation Therapy: A Hybrid Approach

Medical physics (Lancaster), 2016-06, Vol.43 (6), p.3873-3873

2016

Volltextzugriff (PDF)

Pain drawings in the assessment of nerve root compression : A comparative study with lumbar spine magnetic resonance imaging

Spine (Philadelphia, Pa. 1976), 1998-08, Vol.23 (15), p.1668-1676

1998

Volltextzugriff (PDF)

The Poem Is You: 60 Contemporary American Poems and How to Read Them

Burt, Stephanie

1, 2016

Volltextzugriff (PDF)

Black is, black ain't: Classical Reception and Nothingness in Ralph Ellison, Derek Walcott and Wole Soyinka

Revue de littérature comparée, 2013-02, Vol.344 (4), p.457-474

Rankine, Patrice D

2013

Volltextzugriff (PDF)

New nonpeptide angiotensin II receptor antagonists. 2. Synthesis, biological properties, and structure-activity relationships of 2-alkyl-4-(biphenylylmethoxy)quinoline derivatives

Journal of medicinal chemistry, 1992-10, Vol.35 (22), p.4027-4038

1992

Volltextzugriff (PDF)

MRI of lumbar spondylosis: a comparison of sagittal T2 weighted and three sequence examinations

British journal of radiology, 1997-11, Vol.70 (839), p.1112

1997

Volltextzugriff (PDF)

Biochemical comparison of plaque fluid on tooth and acrylic surfaces during a sucrose challenge

Archives of oral biology, 1996-07, Vol.41 (7), p.695-698

1996

Volltextzugriff (PDF)

Plaque fluid pH, calcium and phosphorus responses to calcium food additives in a chewable candy

Archives of oral biology, 1989, Vol.34 (10), p.821-824

1989

Volltextzugriff (PDF)

Sinemet‐ferrous sulphate interaction in patients with Parkinson's disease

British journal of clinical pharmacology, 1990-10, Vol.30 (4), p.599-605

1990

Volltextzugriff (PDF)

1 – 25 von 41

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(33)
Mit Volltextzugriff
(36)

Publikationsform

Sprache

Erscheinungsjahr

n.n

Thema

Science & Technology
(21)
Life Sciences & Biomedicine
(13)
Chemistry
(11)
Humans
(9)
Physical Sciences
(9)
Chemistry, Physical
(8)
Physics
(8)
Physics, Atomic, Molecular & Chemical
(8)
Male
(7)
Female
(5)
Animals
(3)
Biological And Medical Sciences
(3)
Medical Sciences
(3)
Middle Aged
(3)
Neurosciences & Neurology
(3)
Adult
(2)
Artificial Neural Networks
(2)
Calcium - Metabolism
(2)
Clinical Neurology
(2)
Coordination Compounds
(2)

15 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

... seit 90 Tagen
(1)

Menü

Weitere Dienste

Einstellungen

Progress in the Theory of X‑ray Spectroscopy: From Quantum Chemistry to Machine Learning and Ultrafast Dynamics

A Deep Neural Network for the Rapid Prediction of X‑ray Absorption Spectra

Accurate, affordable, and generalizable machine learning simulations of transition metal x-ray absorption spectra using the XANESNET deep neural network

The photochemistry of Rydberg-excited cyclobutanone: Photoinduced processes and ground state dynamics

A deep neural network for valence-to-core X-ray emission spectroscopy

Photo-induced structural dynamics of o -nitrophenol by ultrafast electron diffraction

A theoretical investigation of internal conversion in 1,2-dithiane using non-adiabatic multiconfigurational molecular dynamics

On the analysis of X-ray absorption spectra for polyoxometallates

Atmospheric breakdown chemistry of the new “green” solvent 2,2,5,5-tetramethyloxolane via gas-phase reactions with OH and Cl radicals

Photo-induced structural dynamics of -nitrophenol by ultrafast electron diffraction

Focal Lesions in the Rat Central Nervous System Induced by Endothelin-1

MCP-1 and murine prion disease: Separation of early behavioural dysfunction from overt clinical disease

Sa1000: DIARRHEA, ELEVATED AST, AND ELEVATION OF INFLAMMATORYRELATED BIOMARKERS IS A PREDICTOR FOR MORTALITY IN MINORITY HOSPITALISED COVID-19 PATIENTS

Compression of the dorsalis pedis artery: a novel cause of blue toe syndrome

Handbook of Treatment Planning for Children with Autism and Other Neurodevelopmental Disorders

TH-CD-BRA-02: 3D Remote Dosimetry for MRI-Guided Radiation Therapy: A Hybrid Approach

Pain drawings in the assessment of nerve root compression : A comparative study with lumbar spine magnetic resonance imaging

The Poem Is You: 60 Contemporary American Poems and How to Read Them

Black is, black ain't: Classical Reception and Nothingness in Ralph Ellison, Derek Walcott and Wole Soyinka

New nonpeptide angiotensin II receptor antagonists. 2. Synthesis, biological properties, and structure-activity relationships of 2-alkyl-4-(biphenylylmethoxy)quinoline derivatives

MRI of lumbar spondylosis: a comparison of sagittal T2 weighted and three sequence examinations

Biochemical comparison of plaque fluid on tooth and acrylic surfaces during a sucrose challenge

Plaque fluid pH, calcium and phosphorus responses to calcium food additives in a chewable candy

Sinemet‐ferrous sulphate interaction in patients with Parkinson's disease

Suchergebnisse filtern