Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulations. - Wikidata - wikimedia - TriplyDB

Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulations.

Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulations.

http://www.wikidata.org/entity/Q33901963

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Kinetics of O2 Entry and Exit in Monomeric Sarcosine Oxidase via Markovian Milestoning Molecular Dynamics.Multiscale Estimation of Binding Kinetics Using Brownian Dynamics, Molecular Dynamics and Milestoning.Multiscale implementation of infinite-swap replica exchange molecular dynamics.Rate Constants and Mechanisms of Protein-Ligand Binding.Effect of Outer-Sphere Side Chain Substitutions on the Fate of the trans Iron-Nitrosyl Dimer in Heme/Nonheme Engineered Myoglobins (Fe(B)Mbs): Insights into the Mechanism of Denitrifying NO Reductases A new paradigm for atomically detailed simulations of kinetics in biophysical systems.SEEKR: Simulation Enabled Estimation of Kinetic Rates, A Computational Tool to Estimate Molecular Kinetics and Its Application to Trypsin-Benzamidine Binding.Atomic resolution mechanism of ligand binding to a solvent inaccessible cavity in T4 lysozyme.

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P2860

Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulations.

http://www.wikidata.org/entity/Q33901963

description

2015 nî lūn-bûn

@nan

2015 թուականի Փետրուարին հրատարակուած գիտական յօդուած

@hyw

2015 թվականի փետրվարին հրատարակված գիտական հոդված

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2015年の論文

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2015年論文

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2015年論文

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2015年論文

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2015年論文

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2015年論文

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2015年论文

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name

Full kinetics of CO entry, int ...... ition-path theory simulations.

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Full kinetics of CO entry, int ...... ition-path theory simulations.

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type

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Full kinetics of CO entry, int ...... ition-path theory simulations.

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Full kinetics of CO entry, int ...... ition-path theory simulations.

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prefLabel

Full kinetics of CO entry, int ...... ition-path theory simulations.

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Full kinetics of CO entry, int ...... ition-path theory simulations.

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P1433

Journal of the American Chemical Society

P1476

Full kinetics of CO entry, int ...... ition-path theory simulations.

@en

P2093

Cameron F Abrams

http://www.w3.org/2001/XMLSchema#string

Mauro Lapelosa

http://www.w3.org/2001/XMLSchema#string

Tang-Qing Yu

http://www.w3.org/2001/XMLSchema#string

P2860

Ligand binding and conformational motions in myoglobin

Ligand pathways in myoglobin: a review of Trp cavity mutations

Visualizing breathing motion of internal cavities in concert with ligand migration in myoglobin.

Scalable molecular dynamics with NAMD

Structural dynamics of myoglobin: spectroscopic and structural characterization of ligand docking sites in myoglobin mutant L29W.

Cavities in proteins: structure of a metmyoglobin-xenon complex solved to 1.9 A.

Imaging the migration pathways for O2, CO, NO, and Xe inside myoglobin.

A milestoning study of the kinetics of an allosteric transition: atomically detailed simulations of deoxy Scapharca hemoglobin

Atomic level computational identification of ligand migration pathways between solvent and binding site in myoglobin.

Determination of ligand pathways in globins: apolar tunnels versus polar gates.

P304

3041-3050

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scholarly article

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10.1021/JA512484Q

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8

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137

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Eric Vanden-Eijnden

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2015-02-23T00:00:00Z

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272096038

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25664858

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