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Xiaohu Hu
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Xiaohu Hu

Center for Molecular Biophysics
Building 2040
Room E530
Oak Ridge National Laboratory

Oak Ridge , Tennessee 37830
Work: (865) 241-5237


2016: Ph.D., The University of Tennessee, Knoxville, Tennessee, USA.

2008: Msc. Physics(Diplom Physiker), Ruprecht-Karls-Universität Heidelberg, Heidelberg, Germany.

Research projects:

- Anomalous protein dynamics: Atomic and coarse-grained modeling of protein inter-domain motion, using phosphoglycerate kinase (PGK) as a model system

- Polymer properties of long cellulose single chains

- Antibiotics resistance: Effects of CoA-SH binding on structure and dynamics of aminoglycoside acetyltransferase(3)-IIIb (AAC3-IIIb), an antibiotics resistance causing enzyme

- Dielectric relaxation of bulk water in glassy state exposed to high external electric fields

- Implementation of new features in molecular dynamics simulation software LAMMPS (

- Implementation of novel generalized Born based implicit solvation methmod applied to cellulose simulations

Publications: Here