List of works - Kate A Stafford - Paulina

List of works by Kate A Stafford

Application of computer simulation free-energy methods to compute the free energy of micellization as a function of micelle composition. 1. Theory

scientific article published on 17 January 2008

Application of computer simulation free-energy methods to compute the free energy of micellization as a function of micelle composition. 2. Implementation

scientific article

Automated Event Detection and Activity Monitoring in Long Molecular Dynamics Simulations

article

Conformational preferences underlying reduced activity of a thermophilic ribonuclease H.

scientific article

Efficient reversal of Alzheimer's disease fibril formation and elimination of neurotoxicity by a small molecule

scientific article

Equipartition and the Calculation of Temperature in Biomolecular Simulations

scientific article published in July 2010

Interpreting Protein Structural Dynamics from NMR Chemical Shifts ⬇️

scientific article published on March 28, 2012

Side chain dynamics of carboxyl and carbonyl groups in the catalytic function of Escherichia coli ribonuclease H.

scientific article published on 20 November 2013

Starting‐structure dependence of nanosecond timescale intersubstate transitions and reproducibility of MD‐derived order parameters ⬇️

scientific article published on December 24, 2012

Stochastic pairwise alignments and scoring methods for comparative protein structure modeling.

scientific article

Thermal adaptation of conformational dynamics in ribonuclease H

scientific article (publication date: 2013)

Thermostability of Enzymes from Molecular Dynamics Simulations

scientific article published on 28 April 2016

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