UB Paderborn / Katalog / Suche / in CDI

An online parameter and property database for the TraPPE force field

Molecular simulation, 2014-01, Vol.40 (1-3), p.101-105

2014

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Structure and Dynamics of the Aqueous Liquid−Vapor Interface: A Comprehensive Particle-Based Simulation Study

The journal of physical chemistry. B, 2006-03, Vol.110 (8), p.3738-3746

2006

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Assessing the Quality of Molecular Simulations for Vapor–Liquid Equilibria: An Analysis of the TraPPE Database

Journal of chemical and engineering data, 2020-03, Vol.65 (3), p.1330-1344

2020

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Temperature effects on the spatial distribution of electrolyte mixtures at the aqueous liquid-vapor interface

Physical chemistry chemical physics : PCCP, 2020-05, Vol.22 (19), p.1792-181

2020

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Molecular simulation studies of reversed-phase liquid chromatography

Journal of Chromatography A, 2013-04, Vol.1287, p.60-82

2013

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Size Effects on the Solvation of Anions at the Aqueous Liquid−Vapor Interface

Journal of physical chemistry. C, 2008-01, Vol.112 (1), p.210-218

2008

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Kinetics of peripheral blood chimerism for surveillance of patients with leukemia and chronic myeloid malignancies after reduced-intensity conditioning allogeneic hematopoietic SCT

Bone marrow transplantation (Basingstoke), 2015-05, Vol.50 (5), p.743-745

2015

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Column selection for comprehensive two-dimensional liquid chromatography using the hydrophobic subtraction model

Journal of Chromatography A, 2019-03, Vol.1589, p.47-55

2019

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Modeling helical proteins using residual dipolar couplings, sparse long-range distance constraints and a simple residue-based force field

Theoretical chemistry accounts, 2013-10, Vol.132 (10), p.1388-1388, Article 1388

2013

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Determination of helical membrane protein topology using residual dipolar couplings and exhaustive search algorithm: application to phospholamban

Chemistry and physics of lipids, 2004-11, Vol.132 (1), p.133-144

2004

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P4626Cognitive function correlates with CHA2DS2-VASc score in patients with atrial fibrillation: The Swiss atrial fibrillation cohort study

European heart journal, 2017-08, Vol.38 (suppl_1)

2017

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Assessing the Quality of Molecular Simulations for Vapor–Liquid Equilibria: An Analysis of the TraPPE Database

Journal of chemical and engineering data, 2019-10, Vol.65 (3)

2019

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Application of the TraPPE Force Field to Predicting Isothermal Pressure–Volume Curves at High Pressures and High Temperatures

International journal of thermophysics, 2007-06, Vol.28 (3), p.796-804

2007

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Sensitivity Analysis of Transformer Frequency Responses

2023 INSUCON - 14th International Electrical Insulation Conference (INSUCON), 2023, p.54-59

2023

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Application of the TraPPE force field to predicting isothermal pressure-volume curves at high pressures and high temperatures

International journal of thermophysics, 2006-05, Vol.28 (3)

2006

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Large‐Scale Monte Carlo Simulations for Aggregation, Self‐Assembly, and Phase Equilibria

Multiscale Simulation Methods for Nanomaterials, 2007, p.189-199

2007

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Tuning the Circumference of Six-Porphyrin Nanorings

Journal of the American Chemical Society, 2019-05, Vol.141 (19), p.7965-7971

2019

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The role of phosphoglycans in the susceptibility of Leishmania mexicana to the temporin family of anti-microbial peptides

Molecules (Basel, Switzerland), 2015-02, Vol.20 (2), p.2775-2785

2015

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Validation and clinical application of a multiplex high performance liquid chromatography – tandem mass spectrometry assay for the monitoring of plasma concentrations of 12 antibiotics in patients with severe bacterial infections

Journal of chromatography. B, Analytical technologies in the biomedical and life sciences, 2020-11, Vol.1157, p.122160, Article 122160

2020

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TinyRadarNN: Combining Spatial and Temporal Convolutional Neural Networks for Embedded Gesture Recognition With Short Range Radars

IEEE internet of things journal, 2021-07, Vol.8 (13), p.10336-10346

2021

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Impact of Real-Time Therapeutic Drug Monitoring on the Prescription of Antibiotics in Burn Patients Requiring Admission to the Intensive Care Unit

Antimicrobial agents and chemotherapy, 2018-03, Vol.62 (3)

2018

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Corrigendum to “Validation and clinical application of a multiplex high performance liquid chromatography – Tandem mass spectrometry assay for the monitoring of plasma concentrations of 12 antibiotics in patients with severe bacterial infections” [J. Chromatogr. B 1157 (2020) 122160]

Journal of chromatography. B, Analytical technologies in the biomedical and life sciences, 2022-11, Vol.1211, p.123497-123497, Article 123497

2022

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Exploring the links between peptoid antibacterial activity and toxicity

MedChemComm, 2017-05, Vol.8 (5), p.886-896

2017

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Potential of renewable surplus electricity for power-to-gas and geo-methanation in Switzerland

International journal of hydrogen energy, 2023-05, Vol.48 (39), p.14527-14542

2023

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Peptoid Efficacy against Polymicrobial Biofilms Determined by Using Propidium Monoazide‐Modified Quantitative PCR

Chembiochem : a European journal of chemical biology, 2017-01, Vol.18 (1), p.111-118

2017

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An online parameter and property database for the TraPPE force field

Structure and Dynamics of the Aqueous Liquid−Vapor Interface: A Comprehensive Particle-Based Simulation Study

Assessing the Quality of Molecular Simulations for Vapor–Liquid Equilibria: An Analysis of the TraPPE Database

Temperature effects on the spatial distribution of electrolyte mixtures at the aqueous liquid-vapor interface

Molecular simulation studies of reversed-phase liquid chromatography

Size Effects on the Solvation of Anions at the Aqueous Liquid−Vapor Interface

Kinetics of peripheral blood chimerism for surveillance of patients with leukemia and chronic myeloid malignancies after reduced-intensity conditioning allogeneic hematopoietic SCT

Column selection for comprehensive two-dimensional liquid chromatography using the hydrophobic subtraction model

Modeling helical proteins using residual dipolar couplings, sparse long-range distance constraints and a simple residue-based force field

Determination of helical membrane protein topology using residual dipolar couplings and exhaustive search algorithm: application to phospholamban

P4626Cognitive function correlates with CHA2DS2-VASc score in patients with atrial fibrillation: The Swiss atrial fibrillation cohort study

Assessing the Quality of Molecular Simulations for Vapor–Liquid Equilibria: An Analysis of the TraPPE Database

Application of the TraPPE Force Field to Predicting Isothermal Pressure–Volume Curves at High Pressures and High Temperatures

Sensitivity Analysis of Transformer Frequency Responses

Application of the TraPPE force field to predicting isothermal pressure-volume curves at high pressures and high temperatures

Large‐Scale Monte Carlo Simulations for Aggregation, Self‐Assembly, and Phase Equilibria

Tuning the Circumference of Six-Porphyrin Nanorings

The role of phosphoglycans in the susceptibility of Leishmania mexicana to the temporin family of anti-microbial peptides

Validation and clinical application of a multiplex high performance liquid chromatography – tandem mass spectrometry assay for the monitoring of plasma concentrations of 12 antibiotics in patients with severe bacterial infections

TinyRadarNN: Combining Spatial and Temporal Convolutional Neural Networks for Embedded Gesture Recognition With Short Range Radars

Impact of Real-Time Therapeutic Drug Monitoring on the Prescription of Antibiotics in Burn Patients Requiring Admission to the Intensive Care Unit

Corrigendum to “Validation and clinical application of a multiplex high performance liquid chromatography – Tandem mass spectrometry assay for the monitoring of plasma concentrations of 12 antibiotics in patients with severe bacterial infections” [J. Chromatogr. B 1157 (2020) 122160]

Exploring the links between peptoid antibacterial activity and toxicity

Potential of renewable surplus electricity for power-to-gas and geo-methanation in Switzerland

Peptoid Efficacy against Polymicrobial Biofilms Determined by Using Propidium Monoazide‐Modified Quantitative PCR

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