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...

Accurate determination of solvation free energies of neutral organic compounds from first principles

Nature communications, 2022-01, Vol.13 (1), p.414-414, Article 414

2022

Volltextzugriff (PDF)

Calculation of non-coplanar electron-impact ionization of xenon

Journal of physics. B, Atomic, molecular, and optical physics, 2012-11, Vol.45 (22), p.225202

2012

Volltextzugriff (PDF)

Unstructured tetrahedric meshes for the description of complex three-dimensional sample geometries in Monte Carlo simulation of scanning electron microscopy images for metrology applications

Microelectronics and reliability, 2013-09, Vol.53 (9-11), p.1381-1386

2013

Volltextzugriff (PDF)

Recent progress on the accurate determination of the equation of state of neutron and nuclear matter

Journal of physics. Conference series, 2011-12, Vol.336 (1), p.012014-12

2011

Volltextzugriff (PDF)

Ultrahigh-energy neutrino-nucleon deep-inelastic scattering and the Froissart bound

Physical review letters, 2011-06, Vol.106 (23), p.231802-231802, Article 231802

2011

Volltextzugriff (PDF)

Exact 3D simulation of Scanning Electron Microscopy images of semiconductor devices in the presence of electric and magnetic fields

Microelectronics and reliability, 2014-09, Vol.54 (9-10), p.2081-2087

2014

Volltextzugriff (PDF)

Assessment of performance of the general purpose polarizable force field QMPFF3 in condensed phase

Journal of computational chemistry, 2008-06, Vol.29 (8), p.1242-1249

2008

Volltextzugriff (PDF)

A CASE OF THE EARLY DEVELOPMENT OF ATOPIC DERMATITIS IN A NURSING INFANT

Voprosy sovremennoĭ pediatrii, 2018-07, Vol.17 (3), p.244-249

2018

Volltextzugriff (PDF)

On the importance of accounting for nuclear quantum effects in ab initio calibrated force fields in biological simulations

Proceedings of the National Academy of Sciences - PNAS, 2018-09, Vol.115 (36), p.8878-8882

2018

Volltextzugriff (PDF)

Density-dependent nucleon-nucleon interaction from Urbana UIX three-nucleon force

Journal of physics. Conference series, 2011-12, Vol.336 (1), p.012016-8

2011

Volltextzugriff (PDF)

Combining Force Fields and Neural Networks for an Accurate Representation of Chemically Diverse Molecular Interactions

Journal of the American Chemical Society, 2023-11, Vol.145 (43), p.23620-23629

2023

Volltextzugriff (PDF)

Combining Force Fields and Neural Networks for an Accurate Representation of Bonded Interactions

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-02, Vol.128 (4), p.807-812

2024

Volltextzugriff (PDF)

The Determination of Free Energy of Hydration of Water Ions from First Principles

Journal of chemical theory and computation, 2024-06, Vol.20 (12), p.5215-5224

2024

Volltextzugriff (PDF)

Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties

Journal of chemical theory and computation, 2024-02, Vol.20 (3), p.1347-1357

2024

Volltextzugriff (PDF)

Protein–Ligand Binding Free-Energy Calculations with ARROWA Purely First-Principles Parameterized Polarizable Force Field

Journal of chemical theory and computation, 2022-12, Vol.18 (12), p.7751-7763

2022

Volltextzugriff (PDF)

Prediction of cyclohexane-water distribution coefficient for SAMPL5 drug-like compounds with the QMPFF3 and ARROW polarizable force fields

Journal of computer-aided molecular design, 2016-11, Vol.30 (11), p.977-988

2016

Volltextzugriff (PDF)

Heavy-quark contributions to the ratio F L / F 2 at low x

Physics letters. B, 2008-05, Vol.663 (1-2), p.66-72

2008

Volltextzugriff (PDF)

The use of drug monitoring of infliximab and adalimumab to optimize the treatment of inflammatory bowel diseases in children

Rossiĭskiĭ pediatricheskiĭ zhurnal = Russian journal of pediatrics, 2022-10, Vol.25 (5), p.313-320

2022

Volltextzugriff (PDF)

Exploring the limits of scanning electron microscopy for the metrology of critical dimensions of photoresist structures in the nanometer range

Microelectronics and reliability, 2014-09, Vol.54 (9-10), p.2123-2127

2014

Volltextzugriff (PDF)

Monte Carlo simulation of emission site, angular and energy distributions of secondary electrons in silicon at low beam energies

Microelectronics and reliability, 2012-09, Vol.52 (9-10), p.2139-2143

2012

Volltextzugriff (PDF)

S-pairing in neutron matter: I. Correlated basis function theory

Nuclear physics. A, 2008-05, Vol.803 (3), p.137-158

2008

Volltextzugriff (PDF)

Heavy-quark contributions to the ratio FL/F2 at low x

Physics letters. B, 2008-05, Vol.663 (1-2), p.66-72

2008

Volltextzugriff (PDF)

Small-x behavior of the structure function F2 and its slope ∂lnF2/∂ln(1/x) for “frozen” and analytic strong-coupling constants

Physics letters. B, 2009-08, Vol.679 (4), p.350-354

2009

Volltextzugriff (PDF)

Small-x behavior of the structure function F 2 and its slope ∂ ln F 2 / ∂ ln ( 1 / x ) for “frozen” and analytic strong-coupling constants

Physics letters. B, 2009-08, Vol.679 (4), p.350-354

2009

Volltextzugriff (PDF)

Small-χ behavior of the structure function F2 and its slope ∂ In F2/∂ In(1/x) for frozen and analytic strong-coupling constants

Physics letters. B, 2009, Vol.679 (4), p.350-354

2009

Volltextzugriff (PDF)

1 – 25 von 34

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(27)
Mit Volltextzugriff
(27)

Publikationsform

Sprache

Englisch
(34)

Erscheinungsjahr

n.n

Thema

Science & Technology
(22)
Physical Sciences
(19)
Physics
(18)
Chemistry
(7)
Exact Sciences And Technology
(7)
Computer Simulation
(6)
Physics, Nuclear
(6)
Technology
(6)
Engineering
(5)
Engineering, Electrical & Electronic
(5)
Nuclear Matter
(5)
Physics, Applied
(5)
Physics, Atomic, Molecular & Chemical
(5)
Science & Technology - Other Topics
(5)
Chemistry, Physical
(4)
Free Energy
(4)
Molecular Dynamics
(4)
Nanoscience & Nanotechnology
(4)
Nucleons
(4)
Scanning Electron Microscopy
(4)

15 weitere anzeigen...

Weniger anzeigen...

Menü

Weitere Dienste

Einstellungen

Accurate determination of solvation free energies of neutral organic compounds from first principles

Calculation of non-coplanar electron-impact ionization of xenon

Unstructured tetrahedric meshes for the description of complex three-dimensional sample geometries in Monte Carlo simulation of scanning electron microscopy images for metrology applications

Recent progress on the accurate determination of the equation of state of neutron and nuclear matter

Ultrahigh-energy neutrino-nucleon deep-inelastic scattering and the Froissart bound

Exact 3D simulation of Scanning Electron Microscopy images of semiconductor devices in the presence of electric and magnetic fields

Assessment of performance of the general purpose polarizable force field QMPFF3 in condensed phase

A CASE OF THE EARLY DEVELOPMENT OF ATOPIC DERMATITIS IN A NURSING INFANT

On the importance of accounting for nuclear quantum effects in ab initio calibrated force fields in biological simulations

Density-dependent nucleon-nucleon interaction from Urbana UIX three-nucleon force

Combining Force Fields and Neural Networks for an Accurate Representation of Chemically Diverse Molecular Interactions

Combining Force Fields and Neural Networks for an Accurate Representation of Bonded Interactions

The Determination of Free Energy of Hydration of Water Ions from First Principles

Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties

Protein–Ligand Binding Free-Energy Calculations with ARROWA Purely First-Principles Parameterized Polarizable Force Field

Prediction of cyclohexane-water distribution coefficient for SAMPL5 drug-like compounds with the QMPFF3 and ARROW polarizable force fields

Heavy-quark contributions to the ratio F L / F 2 at low x

The use of drug monitoring of infliximab and adalimumab to optimize the treatment of inflammatory bowel diseases in children

Exploring the limits of scanning electron microscopy for the metrology of critical dimensions of photoresist structures in the nanometer range

Monte Carlo simulation of emission site, angular and energy distributions of secondary electrons in silicon at low beam energies

S-pairing in neutron matter: I. Correlated basis function theory

Heavy-quark contributions to the ratio FL/F2 at low x

Small-x behavior of the structure function F2 and its slope ∂lnF2/∂ln(1/x) for “frozen” and analytic strong-coupling constants

Small-x behavior of the structure function F 2 and its slope ∂ ln F 2 / ∂ ln ( 1 / x ) for “frozen” and analytic strong-coupling constants

Small-χ behavior of the structure function F2 and its slope ∂ In F2/∂ In(1/x) for frozen and analytic strong-coupling constants

Suchergebnisse filtern