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...

Binding of inhibitors to the monomeric and dimeric SARS-CoV-2 Mpro

RSC advances, 2021-01, Vol.11 (5), p.2926-2934

2021

Volltextzugriff (PDF)

On multi-resident activity recognition in ambient smart-homes

The Artificial intelligence review, 2020-08, Vol.53 (6), p.3929-3945

2020

Volltextzugriff (PDF)

Rapid prediction of possible inhibitors for SARS-CoV-2 main protease using docking and FPL simulations

RSC advances, 2020-08, Vol.1 (53), p.31991-31996

2020

Volltextzugriff (PDF)

Assessing potential inhibitors of SARS-CoV-2 main protease from available drugs using free energy perturbation simulations

RSC advances, 2020-11, Vol.1 (66), p.4284-429

2020

Volltextzugriff (PDF)

Mixed-dependency models for multi-resident activity recognition in smart homes

Multimedia tools and applications, 2020-08, Vol.79 (31-32), p.23445-23460

2020

Volltextzugriff (PDF)

Estimating the ligand‐binding affinity via λ‐dependent umbrella sampling simulations

Journal of computational chemistry, 2021-01, Vol.42 (2), p.117-123

Ngo, Son Tung

2021

Volltextzugriff (PDF)

Copper active site in polysaccharide monooxygenases

Coordination chemistry reviews, 2018-08, Vol.368, p.134-157

2018

Volltextzugriff (PDF)

A Computer-Vision Based Application for Student Behavior Monitoring in Classroom

Applied sciences, 2019-11, Vol.9 (22), p.4729

2019

Volltextzugriff (PDF)

Potential inhibitors for SARS-CoV-2 Mpro from marine compounds

RSC advances, 2021-06, Vol.11 (36), p.2226-22213

2021

Volltextzugriff (PDF)

Genetic Algorithm for Solving Multi-Objective Optimization in Examination Timetabling Problem

International journal of emerging technologies in learning, 2021-01, Vol.16 (11), p.4

2021

Volltextzugriff (PDF)

Benchmark of Popular Free Energy Approaches Revealing the Inhibitors Binding to SARS-CoV-2 Mpro

Journal of chemical information and modeling, 2021-05, Vol.61 (5), p.2302-2312

2021

Volltextzugriff (PDF)

Autodock Vina Adopts More Accurate Binding Poses but Autodock4 Forms Better Binding Affinity

Journal of chemical information and modeling, 2020-01, Vol.60 (1), p.204-211

2020

Volltextzugriff (PDF)

A Compromise Programming to Task Assignment Problem in Software Development Project

Computers, materials & continua, 2021, Vol.69 (3), p.3429-3444

2021

Volltextzugriff (PDF)

Computational Determination of Potential Inhibitors of SARS-CoV‑2 Main Protease

Journal of chemical information and modeling, 2020-12, Vol.60 (12), p.5771-5780

2020

Volltextzugriff (PDF)

Probable Transmembrane Amyloid α‑Helix Bundles Capable of Conducting Ca2+ Ions

The journal of physical chemistry. B, 2019-03, Vol.123 (12), p.2645-2653

2019

Volltextzugriff (PDF)

Fast and accurate determination of the relative binding affinities of small compounds to HIV-1 protease using non-equilibrium work

Journal of computational chemistry, 2016-12, Vol.37 (31), p.2734-2742

2016

Volltextzugriff (PDF)

Insights into the binding and covalent inhibition mechanism of PF-07321332 to SARS-CoV-2 M pro

RSC advances, 2022-01, Vol.12 (6), p.3729-3737

2022

Volltextzugriff (PDF)

Oversampling Free Energy Perturbation Simulation in Determination of the Ligand‐Binding Free Energy

Journal of computational chemistry, 2020-03, Vol.41 (7), p.611-618

2020

Volltextzugriff (PDF)

Determination of the absolute binding free energies of HIV-1 protease inhibitors using non-equilibrium molecular dynamics simulations

Chemical physics letters, 2017-05, Vol.676, p.12-17

2017

Volltextzugriff (PDF)

How do magnetic, structural, and electronic criteria of aromaticity relate to HOMO – LUMO gap? An evaluation for graphene quantum dot and its derivatives

Chemical physics, 2020-11, Vol.539, p.110951, Article 110951

2020

Volltextzugriff (PDF)

Inhibition of Aggregation of Amyloid Peptides by Beta-Sheet Breaker Peptides and Their Binding Affinity

The journal of physical chemistry. B, 2011-06, Vol.115 (22), p.7433-7446

2011

Volltextzugriff (PDF)

Characterizing the ligand-binding affinity toward SARS-CoV-2 Mpro via physics- and knowledge-based approaches

Physical chemistry chemical physics : PCCP, 2022-12, Vol.24 (48), p.29266-29278

2022

Volltextzugriff (PDF)

DFT investigation of Au9M2+ nanoclusters (M = Sc-Ni): The magnetic superatomic behavior of Au9Cr2

Chemical physics letters, 2022-04, Vol.793, p.139451, Article 139451

2022

Volltextzugriff (PDF)

Effect of Cholesterol Molecules on Aβ1-42 Wild-Type and Mutants Trimers

Molecules (Basel, Switzerland), 2022-02, Vol.27 (4), p.1395

2022

Volltextzugriff (PDF)

1 – 25 von 259

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(190)
Mit Volltextzugriff
(228)

Publikationsform

Sprache

Englisch
(251)
Französisch
(2)

Erscheinungsjahr

n.n

Thema

Science & Technology
(140)
Physical Sciences
(87)
Chemistry
(71)
Technology
(51)
Chemistry, Multidisciplinary
(40)
Life Sciences & Biomedicine
(36)
Computer Science
(32)
Physics
(28)
Ligands
(23)
Binding
(22)
Humans
(22)
Molecular Dynamics
(21)
Chemistry, Physical
(20)
Free Energy
(20)
Machine Learning
(17)
Molecular Dynamics Simulation
(16)
Severe Acute Respiratory Syndrome Coronavirus 2
(16)
Computer Science, Interdisciplinary Applications
(15)
Engineering
(15)
Science & Technology - Other Topics
(15)

15 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

Menü

Weitere Dienste

Einstellungen

Binding of inhibitors to the monomeric and dimeric SARS-CoV-2 Mpro

On multi-resident activity recognition in ambient smart-homes

Rapid prediction of possible inhibitors for SARS-CoV-2 main protease using docking and FPL simulations

Assessing potential inhibitors of SARS-CoV-2 main protease from available drugs using free energy perturbation simulations

Mixed-dependency models for multi-resident activity recognition in smart homes

Estimating the ligand‐binding affinity via λ‐dependent umbrella sampling simulations

Copper active site in polysaccharide monooxygenases

A Computer-Vision Based Application for Student Behavior Monitoring in Classroom

Potential inhibitors for SARS-CoV-2 Mpro from marine compounds

Genetic Algorithm for Solving Multi-Objective Optimization in Examination Timetabling Problem

Benchmark of Popular Free Energy Approaches Revealing the Inhibitors Binding to SARS-CoV-2 Mpro

Autodock Vina Adopts More Accurate Binding Poses but Autodock4 Forms Better Binding Affinity

A Compromise Programming to Task Assignment Problem in Software Development Project

Amyloid Oligomers: A Joint Experimental/Computational Perspective on Alzheimer’s Disease, Parkinson’s Disease, Type II Diabetes, and Amyotrophic Lateral Sclerosis

Computational Determination of Potential Inhibitors of SARS-CoV‑2 Main Protease

Probable Transmembrane Amyloid α‑Helix Bundles Capable of Conducting Ca2+ Ions

Fast and accurate determination of the relative binding affinities of small compounds to HIV-1 protease using non-equilibrium work

Insights into the binding and covalent inhibition mechanism of PF-07321332 to SARS-CoV-2 M pro

Oversampling Free Energy Perturbation Simulation in Determination of the Ligand‐Binding Free Energy

Determination of the absolute binding free energies of HIV-1 protease inhibitors using non-equilibrium molecular dynamics simulations

How do magnetic, structural, and electronic criteria of aromaticity relate to HOMO – LUMO gap? An evaluation for graphene quantum dot and its derivatives

Inhibition of Aggregation of Amyloid Peptides by Beta-Sheet Breaker Peptides and Their Binding Affinity

Characterizing the ligand-binding affinity toward SARS-CoV-2 Mpro via physics- and knowledge-based approaches

DFT investigation of Au9M2+ nanoclusters (M = Sc-Ni): The magnetic superatomic behavior of Au9Cr2

Effect of Cholesterol Molecules on Aβ1-42 Wild-Type and Mutants Trimers

Suchergebnisse filtern