Empirical Optimization of Interactions between Proteins and Chemical Denaturants in Molecular Simulations.

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Consistent View of Polypeptide Chain Expansion in Chemical Denaturants from Multiple Experimental Methods.Probing the Action of Chemical Denaturant on an Intrinsically Disordered Protein by Simulation and Experiment.Molecular recognition and packing frustration in a helical protein.

P2860

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P2860

Empirical Optimization of Interactions between Proteins and Chemical Denaturants in Molecular Simulations.

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2015 nî lūn-bûn

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Empirical Optimization of Inte ...... ants in Molecular Simulations.

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Empirical Optimization of Inte ...... ants in Molecular Simulations.

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Empirical Optimization of Inte ...... ants in Molecular Simulations.

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P1476

Empirical Optimization of Inte ...... ants in Molecular Simulations.

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P2093

Alessandro Borgia

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Madeleine B Borgia

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Wenwei Zheng

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P2860

Designing a 20-residue protein

GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

A general purpose model for the condensed phases of water: TIP4P/2005

A point-charge force field for molecular mechanics simulations of proteins based on condensed-phase quantum mechanical calculations

A biomolecular force field based on the free enthalpy of hydration and solvation: the GROMOS force-field parameter sets 53A5 and 53A6

Force Field for Peptides and Proteins based on the Classical Drude Oscillator

Structure and energetics of the hydrogen-bonded backbone in protein folding.

Contribution of hydration to protein folding thermodynamics. I. The enthalpy of hydration.

Alchemical free energy methods for drug discovery: progress and challenges

Statistically optimal analysis of samples from multiple equilibrium states.

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5543-5553

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scholarly article

P356

10.1021/ACS.JCTC.5B00778

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P478

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Robert B. Best

Benjamin Schuler

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2015-10-13T00:00:00Z

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26574341

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6139257

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Empirical Optimization of Interactions between Proteins and Chemical Denaturants in Molecular Simulations.

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P2860

P2860

Empirical Optimization of Interactions between Proteins and Chemical Denaturants in Molecular Simulations.

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type

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P1433

P1476

P2093

P2860

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P698

P932

P356

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P2093

P2860

P304

P31

P356

P433

P478

P50

P577

P698

P932