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List of works by Xiao Zhu

Atomistic simulations of dilute polyelectrolyte solutions.

scientific article published on 3 April 2012

Dichlorophenylacrylonitriles as AhR Ligands That Display Selective Breast Cancer Cytotoxicity in vitro

scientific article published on 02 July 2018

Establishing Effective Simulation Protocols for β- and α/β-Mixed Peptides. I. QM and QM/MM Models

scientific article published on 01 July 2007

Establishing effective simulation protocols for beta- and alpha/beta-peptides. II. Molecular mechanical (MM) model for a cyclic beta-residue.

scientific article

Establishing effective simulation protocols for beta- and alpha/beta-peptides. III. Molecular mechanical model for acyclic beta-amino acids.

scientific article published in July 2010

Fast and accurate computation schemes for evaluating vibrational entropy of proteins.

scientific article published on 27 August 2011

Local DNA dynamics shape mutational patterns of mononucleotide repeats in human genomes

scientific article published on 20 April 2015

Modeling DNA-Bending in the Nucleosome: Role of AA Periodicity ⬇️

scientific article published on June 16, 2011

Molecular dynamics study of the role of the spine of hydration in DNA A-tracts in determining nucleosome occupancy.

scientific article published on 14 November 2012

Optimization of Ported CFD Kernels on Intel Data Center GPU Max 1550 using oneAPI ESIMD

scientific article published on 10 November 2023

Potential of mean force for insertion of antimicrobial peptide melittin into a pore in mixed DOPC/DOPG lipid bilayer by molecular dynamics simulation

scientific article published in April 2017

Sequence-dependent interaction of β-peptides with membranes

scientific article published on 01 October 2010

Sequence-dependent pKa shift induced by molecular self-assembly: insights from computer simulation

scientific article published on 12 December 2011

Temperature-activated nucleic acid nanostructures.

scientific article published on 16 September 2013

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