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...

Modeling Structural Dynamics of Biomolecular Complexes by Coarse-Grained Molecular Simulations

Accounts of chemical research, 2015-12, Vol.48 (12), p.3026-3035

2015

Volltextzugriff (PDF)

Nucleosome Crowding in Chromatin Slows the Diffusion but Can Promote Target Search of Proteins

Biophysical journal, 2019-06, Vol.116 (12), p.2285-2295

2019

Volltextzugriff (PDF)

CafeMol: A Coarse-Grained Biomolecular Simulator for Simulating Proteins at Work

Journal of chemical theory and computation, 2011-06, Vol.7 (6), p.1979-1989

2011

Volltextzugriff (PDF)

Coarse-Grained Diffraction Template Matching Model to Retrieve Multiconformational Models for Biomolecule Structures from Noisy Diffraction Patterns

Journal of chemical information and modeling, 2020-06, Vol.60 (6), p.2803-2818

2020

Volltextzugriff (PDF)

A thermodynamically consistent monte carlo cross-bridge model with a trapping mechanism reveals the role of stretch activation in heart pumping

Frontiers in physiology, 2022-09, Vol.13, p.855303-855303

2022

Volltextzugriff (PDF)

Microsecond-timescale MD simulation of EGFR minor mutation predicts the structural flexibility of EGFR kinase core that reflects EGFR inhibitor sensitivity

NPJ precision oncology, 2021-04, Vol.5 (1), p.32-32, Article 32

2021

Volltextzugriff (PDF)

Exploring Successful Parameter Region for Coarse-Grained Simulation of Biomolecules by Bayesian Optimization and Active Learning

Biomolecules (Basel, Switzerland), 2020-03, Vol.10 (3), p.482

2020

Volltextzugriff (PDF)

Structure-based molecular simulations reveal the enhancement of biased Brownian motions in single-headed kinesin

PLoS computational biology, 2013-02, Vol.9 (2), p.e1002907-e1002907

2013

Volltextzugriff (PDF)

Coupling Langevin Dynamics With Continuum Mechanics: Exposing the Role of Sarcomere Stretch Activation Mechanisms to Cardiac Function

Frontiers in physiology, 2018-04, Vol.9, p.333-333

2018

Volltextzugriff (PDF)

Energetics of the single-headed kinesin KIF1A

Physical review. E, Statistical, nonlinear, and soft matter physics, 2013-08, Vol.88 (2), p.022711-022711, Article 022711

2013

Volltextzugriff (PDF)

Enhanced Conformational Sampling with an Adaptive Coarse-Grained Elastic Network Model Using Short-Time All-Atom Molecular Dynamics

Journal of chemical theory and computation, 2022-04, Vol.18 (4), p.2062-2074

2022

Volltextzugriff (PDF)

Synthesis of Multiwalled Carbon Nanocoils Using Codeposited Thin Film of Fe–Sn as Catalyst

Japanese Journal of Applied Physics, 2008-04, Vol.47 (4R), p.1949

2008

Volltextzugriff (PDF)

Efficiency of Energy Transduction in a Molecular Chemical Engine

Journal of the Physical Society of Japan, 2007-02, Vol.76 (2), p.23003

2007

Volltextzugriff (PDF)

Theoretical model for motility and processivity of two-headed molecular motors

Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics, 2003-06, Vol.67 (6 Pt 1), p.061917-061917, Article 061917

2003

Volltextzugriff (PDF)

Enhanced Coarse-Grained Molecular Dynamics Simulation with a Smoothed Hybrid Potential Using a Neural Network Model

Journal of chemical theory and computation, 2024-01, Vol.20 (1), p.7-17

2024

Volltextzugriff (PDF)

Allosterically Regulated Structural Fluctuation and Microtubule-Binding Affinity of KiF1A -- A Simulation Study of Coarse-Grained Model

Biophysical journal, 2016-02, Vol.110 (3), p.459a-459a

2016

Volltextzugriff (PDF)

Using incomplete Cholesky factorization to increase the time step in molecular dynamics simulations

Journal of computational and applied mathematics, 2022-12, Vol.415, p.114519, Article 114519

2022

Volltextzugriff (PDF)

Protein–ligand binding affinity prediction of cyclin‐dependent kinase‐2 inhibitors by dynamically averaged fragment molecular orbital‐based interaction energy

Journal of computational chemistry, 2022-07, Vol.43 (20), p.1362-1371

2022

Volltextzugriff (PDF)

Prediction of ALK mutations mediating ALK-TKIs resistance and drug re-purposing to overcome the resistance

EBioMedicine, 2019-03, Vol.41, p.105-119

2019

Volltextzugriff (PDF)

Semi-Implicit Time Integration with Hessian Eigenvalue Corrections for a Larger Time Step in Molecular Dynamics Simulations

Journal of chemical theory and computation, 2021-09, Vol.17 (9), p.5792-5804

2021

Volltextzugriff (PDF)

Nucleotide-dependent structural fluctuations and regulation of microtubule-binding affinity of KIF1A

Proteins, structure, function, and bioinformatics, 2015-05, Vol.83 (5), p.809-819

2015

Volltextzugriff (PDF)

High-Precision Atomic Charge Prediction for Protein Systems Using Fragment Molecular Orbital Calculation and Machine Learning

Journal of chemical information and modeling, 2020-07, Vol.60 (7), p.3361-3368

2020

Volltextzugriff (PDF)

Nucleotide-dependent structural fluctuations and regulation of microtubule-binding affinity of KIF1A: Nucleotide-Dependent Structural Fluctuations of KIF1A

Proteins, structure, function, and bioinformatics, 2015-05, Vol.83 (5), p.809-819

2015

Volltextzugriff (PDF)

Stabilization Mechanism for a Nonfibrillar Amyloid β Oligomer Based on Formation of a Hydrophobic Core Determined by Dissipative Particle Dynamics

ACS chemical neuroscience, 2020-02, Vol.11 (3), p.385-394

2020

Volltextzugriff (PDF)

Diffusion enhancement of Brownian motors revealed by a solvable model

Physical review. E, 2018-12, Vol.98 (6), Article 062110

2018

Volltextzugriff (PDF)

1 – 25 von 65

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(62)
Mit Volltextzugriff
(60)

Publikationsform

Artikel
(64)
Tagungsberichte
(1)

Sprache

Englisch
(63)
Japanisch
(3)

Erscheinungsjahr

n.n

Thema

Science & Technology
(28)
Physical Sciences
(17)
Life Sciences & Biomedicine
(13)
Physics
(11)
Chemistry
(9)
Molecular Dynamics
(9)
Molecular Dynamics Simulation
(8)
Animals
(6)
Proteins
(6)
Chemistry, Multidisciplinary
(5)
Chemistry, Physical
(5)
Humans
(5)
Pharmacology & Pharmacy
(5)
Biochemistry & Molecular Biology
(4)
Biomolecules
(4)
Computer Simulation
(4)
Kinases
(4)
Mice
(4)
Physics, Atomic, Molecular & Chemical
(4)
Simulation
(4)

15 weitere anzeigen...

Weniger anzeigen...

Zeitschrift / Serie

5 weitere anzeigen...

Weniger anzeigen...

Menü

Weitere Dienste

Einstellungen

Modeling Structural Dynamics of Biomolecular Complexes by Coarse-Grained Molecular Simulations

Nucleosome Crowding in Chromatin Slows the Diffusion but Can Promote Target Search of Proteins

CafeMol: A Coarse-Grained Biomolecular Simulator for Simulating Proteins at Work

Coarse-Grained Diffraction Template Matching Model to Retrieve Multiconformational Models for Biomolecule Structures from Noisy Diffraction Patterns

A thermodynamically consistent monte carlo cross-bridge model with a trapping mechanism reveals the role of stretch activation in heart pumping

Microsecond-timescale MD simulation of EGFR minor mutation predicts the structural flexibility of EGFR kinase core that reflects EGFR inhibitor sensitivity

Exploring Successful Parameter Region for Coarse-Grained Simulation of Biomolecules by Bayesian Optimization and Active Learning

Structure-based molecular simulations reveal the enhancement of biased Brownian motions in single-headed kinesin

Coupling Langevin Dynamics With Continuum Mechanics: Exposing the Role of Sarcomere Stretch Activation Mechanisms to Cardiac Function

Energetics of the single-headed kinesin KIF1A

Enhanced Conformational Sampling with an Adaptive Coarse-Grained Elastic Network Model Using Short-Time All-Atom Molecular Dynamics

Synthesis of Multiwalled Carbon Nanocoils Using Codeposited Thin Film of Fe–Sn as Catalyst

Efficiency of Energy Transduction in a Molecular Chemical Engine

Theoretical model for motility and processivity of two-headed molecular motors

Enhanced Coarse-Grained Molecular Dynamics Simulation with a Smoothed Hybrid Potential Using a Neural Network Model

Allosterically Regulated Structural Fluctuation and Microtubule-Binding Affinity of KiF1A -- A Simulation Study of Coarse-Grained Model

Using incomplete Cholesky factorization to increase the time step in molecular dynamics simulations

Protein–ligand binding affinity prediction of cyclin‐dependent kinase‐2 inhibitors by dynamically averaged fragment molecular orbital‐based interaction energy

Prediction of ALK mutations mediating ALK-TKIs resistance and drug re-purposing to overcome the resistance

Semi-Implicit Time Integration with Hessian Eigenvalue Corrections for a Larger Time Step in Molecular Dynamics Simulations

Nucleotide-dependent structural fluctuations and regulation of microtubule-binding affinity of KIF1A

High-Precision Atomic Charge Prediction for Protein Systems Using Fragment Molecular Orbital Calculation and Machine Learning

Nucleotide-dependent structural fluctuations and regulation of microtubule-binding affinity of KIF1A: Nucleotide-Dependent Structural Fluctuations of KIF1A

Stabilization Mechanism for a Nonfibrillar Amyloid β Oligomer Based on Formation of a Hydrophobic Core Determined by Dissipative Particle Dynamics

Diffusion enhancement of Brownian motors revealed by a solvable model

Suchergebnisse filtern