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Microscopic Understanding of the Effect of Ionic Liquid on Protein from Molecular Simulation Studies

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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LINCS: A linear constraint solver for molecular simulations
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Effect of available volumes on radial distribution functions
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Fast and robust Delaunay tessellation in periodic domains
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Salt bridges: Geometrically specific, designable interactions
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Molecular dynamics investigation of the ionic liquid/enzyme interface: Application to engineering enzyme surface charge
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Knowledge‐based protein secondary structure assignment
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Do water molecules mediate protein-DNA recognition? 1 1Edited by B. Honig
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Computer Simulation of Liquids
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VMD: Visual molecular dynamics
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Sequence of the murine α-lactalbumin-encoding cDNA: interspecies comparison of the coding frame and deduced preprotein
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Principles of nuclear magnetic resonance in one and two dimensions
inferredcites →https://doi.org/10.1016/j.bej.2015.10.024openalex-snapshot
Understanding the molecular behaviour of Renilla luciferase in imidazolium-based ionic liquids, a new model for the α/β fold collapse
inferredcites →https://doi.org/10.1016/j.bpj.2014.12.043openalex-snapshot
Comparison of Three Ionic Liquid-Tolerant Cellulases by Molecular Dynamics
inferredcites →https://doi.org/10.1016/j.enzmictec.2005.02.014openalex-snapshot
Ionic liquids: Green solvents for nonaqueous biocatalysis
inferredcites →https://doi.org/10.1016/j.jbiotec.2009.04.011openalex-snapshot
Hofmeister effects: an explanation for the impact of ionic liquids on biocatalysis
inferredcites →https://doi.org/10.1016/j.jmgm.2015.06.016openalex-snapshot
Effects of imidazolium-based ionic liquids on the stability and dynamics of gramicidin A and lipid bilayers at different salt concentrations
inferredcites →https://doi.org/10.1016/j.jphotobiol.2014.03.007openalex-snapshot
Deciphering the interaction of a model transport protein with a prototypical imidazolium room temperature ionic liquid: Effect on the conformation and activity of the protein
inferredcites →https://doi.org/10.1016/j.softx.2015.06.001openalex-snapshot
GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers
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Application of the Stretched Exponential Function to Fluorescence Lifetime Imaging
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inferredcites →https://doi.org/10.1016/s0021-9258(19)36512-3openalex-snapshot
Alpha-lactalbumin possesses a distinct zinc binding site.
inferredcites →https://doi.org/10.1016/s0065-3233(08)60190-4openalex-snapshot
Linked Functions and Reciprocal Effects in Hemoglobin: A Second Look
inferredcites →https://doi.org/10.1016/s0958-1669(02)00353-1openalex-snapshot
Enzyme catalysis in ionic liquids
inferredcites →https://doi.org/10.1016/s0969-2126(96)00075-5openalex-snapshot
Crystal structures of guinea-pig, goat and bovine α-lactalbumin highlight the enhanced conformational flexibility of regions that are significant for its action in lactose synthase
inferredcites →https://doi.org/10.1021/acs.jpcb.6b05328openalex-snapshot
Ab Initio Force Fields for Imidazolium-Based Ionic Liquids
inferredcites →https://doi.org/10.1021/acs.jpcb.6b09410openalex-snapshot
Destabilization of Human Serum Albumin by Ionic Liquids Studied Using Enhanced Molecular Dynamics Simulations
inferredcites →https://doi.org/10.1021/cr050946xopenalex-snapshot
Biocatalysis in Ionic Liquids
inferredcites →https://doi.org/10.1021/cr2003773openalex-snapshot
Overview of the Stability of α-Chymotrypsin in Different Solvent Media
inferredcites →https://doi.org/10.1021/cs500978xopenalex-snapshot
NMR-Guided Rational Engineering of an Ionic-Liquid-Tolerant Lipase
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What NMR Relaxation Can Tell Us about the Internal Motion of an RNA Hairpin: A Molecular Dynamics Simulation Study
inferredcites →https://doi.org/10.1021/ct900009aopenalex-snapshot
Development of OPLS-AA Force Field Parameters for 68 Unique Ionic Liquids
inferredcites →https://doi.org/10.1021/ie101441sopenalex-snapshot
Thermophysical Properties of Pure Ionic Liquids: Review of Present Situation
inferredcites →https://doi.org/10.1021/ja00381a009openalex-snapshot
Model-free approach to the interpretation of nuclear magnetic resonance relaxation in macromolecules. 1. Theory and range of validity
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Nanosecond Time Scale Motions in Proteins Revealed by High-Resolution NMR Relaxometry
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Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
inferredcites →https://doi.org/10.1021/jp0363996openalex-snapshot
Proteins in Mixed Solvents: A Molecular-Level Perspective
inferredcites →https://doi.org/10.1021/jp047480ropenalex-snapshot
Physicochemical Properties and Structures of Room Temperature Ionic Liquids. 1. Variation of Anionic Species
inferredcites →https://doi.org/10.1021/jp0766050openalex-snapshot
Protein Structure and Dynamics in Ionic Liquids. Insights from Molecular Dynamics Simulation Studies
inferredcites →https://doi.org/10.1021/jp105611bopenalex-snapshot
Characterization of the Influence of the Ionic Liquid 1-Butyl-3-methylimidazolium Chloride on the Structure and Thermal Stability of Green Fluorescent Protein
inferredcites →https://doi.org/10.1021/jp2100733openalex-snapshot
Interfacial Viscoelasticity of Myoglobin at Air/Water and Air/Solution Interfaces: Role of Folding and Clustering
inferredcites →https://doi.org/10.1021/jp3057064openalex-snapshot
High Ionic Liquid Concentration-Induced Structural Change of Protein in Aqueous Solution: A Case Study of Lysozyme
inferredcites →https://doi.org/10.1021/jp308443fopenalex-snapshot
Structural Basis for the Enhanced Stability of Protein Model Compounds and Peptide Backbone Unit in Ammonium Ionic Liquids
inferredcites →https://doi.org/10.1021/jp310198fopenalex-snapshot
Microviscosity-Induced Conformational Transition in β-Lactoglobulin in the Presence of an Ionic Liquid
inferredcites →https://doi.org/10.1021/jp312299dopenalex-snapshot
Structural and Dynamic Features of Candida rugosa Lipase 1 in Water, Octane, Toluene, and Ionic Liquids BMIM-PF6 and BMIM-NO3
inferredcites →https://doi.org/10.1021/jp404760wopenalex-snapshot
Mediating Electrostatic Binding of 1-Butyl-3-methylimidazolium Chloride to Enzyme Surfaces Improves Conformational Stability
inferredcites →https://doi.org/10.1021/jp405834nopenalex-snapshot
Ionic Liquid-Induced Formation of the α-Helical Structure of β-Lactoglobulin
inferredcites →https://doi.org/10.1021/jp500958ropenalex-snapshot
Evaluating the Strength of Salt Bridges: A Comparison of Current Biomolecular Force Fields
inferredcites →https://doi.org/10.1023/a:1011697609756openalex-snapshot
Over-stabilization of Candida antarctica lipase B by ionic liquids in ester synthesis
inferredcites →https://doi.org/10.1023/a:1015564608261openalex-snapshot
At low water activity α-chymotrypsin is more active in an ionic liquid than in non-ionic organic solvents
inferredcites →https://doi.org/10.1038/nm.2161openalex-snapshot
An autoimmune-mediated strategy for prophylactic breast cancer vaccination
inferredcites →https://doi.org/10.1039/b401304mopenalex-snapshot
Fluorescence studies of protein thermostability in ionic liquidsElectronic supplementary information (ESI) available: synthesis of [C4mpy][Tf2N]. See http://www.rsc.org/suppdata/cc/b4/b401304m/
inferredcites →https://doi.org/10.1039/b504681popenalex-snapshot
Molecular dynamics simulation of room-temperature ionic liquid mixture of [bmim][BF4] and acetonitrile by a refined force field
inferredcites →https://doi.org/10.1039/c0cp02487bopenalex-snapshot
Solvation studies of a zinc finger protein in hydrated ionic liquids
inferredcites →https://doi.org/10.1039/c1gc15691hopenalex-snapshot
Green fluorescent protein as a screen for enzymatic activity in ionic liquid–aqueous systems for in situhydrolysis of lignocellulose
inferredcites →https://doi.org/10.1039/c3cp53395fopenalex-snapshot
Protein destabilisation in ionic liquids: the role of preferential interactions in denaturation
inferredcites →https://doi.org/10.1039/c4cp04060kopenalex-snapshot
Mechanisms of hydrogen bond formation between ionic liquids and cellulose and the influence of water content
inferredcites →https://doi.org/10.1039/c6me00047aopenalex-snapshot
Kinetics and mechanism of ionic-liquid induced protein unfolding: application to the model protein HP35
inferredcites →https://doi.org/10.1039/c7nj02900dopenalex-snapshot
A spectroscopic and molecular dynamics simulation approach towards the stabilizing effect of ammonium-based ionic liquids on bovine serum albumin
inferredcites →https://doi.org/10.1042/bj1850227openalex-snapshot
Purification and characterization of mouse α-lactalbumin and preparation of its antibody
inferredcites →https://doi.org/10.1063/1.2408420openalex-snapshot
Canonical sampling through velocity rescaling
inferredcites →https://doi.org/10.1063/1.3127782openalex-snapshot
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inferredcites →https://doi.org/10.1063/1.328693openalex-snapshot
Polymorphic transitions in single crystals: A new molecular dynamics method
inferredcites →https://doi.org/10.1063/1.445869openalex-snapshot
Comparison of simple potential functions for simulating liquid water
inferredcites →https://doi.org/10.1063/1.448118openalex-snapshot
Molecular dynamics with coupling to an external bath
inferredcites →https://doi.org/10.1063/1.464397openalex-snapshot
Particle mesh Ewald: An N ⋅log( N ) method for Ewald sums in large systems
inferredcites →https://doi.org/10.1063/1.470648openalex-snapshot
Constant pressure molecular dynamics simulation: The Langevin piston method
inferredcites →https://doi.org/10.1063/1.4821588openalex-snapshot
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inferredcites →https://doi.org/10.1063/1.4931974openalex-snapshot
Ionic liquid induced dehydration and domain closure in lysozyme: FCS and MD simulation
inferredcites →https://doi.org/10.1073/pnas.122225399openalex-snapshot
Protein-solvent preferential interactions, protein hydration, and the modulation of biochemical reactions by solvent components
inferredcites →https://doi.org/10.1073/pnas.92.7.2835openalex-snapshot
Lactation is disrupted by alpha-lactalbumin deficiency and can be restored by human alpha-lactalbumin gene replacement in mice.
inferredcites →https://doi.org/10.1103/physreve.58.r1226openalex-snapshot
Relaxation dynamics in ultrathin polymer films

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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