ZhangGroup-MITChemistry

ZhangGroup-MITChemistry

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Home Page:http://zhanggroup.mit.edu

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ZhangGroup-MITChemistry's repositories

OpenABC

OpenMM implementation of MOFF, MRG-CG, and HPS models.

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MOFF

Implementation of MOFF force field. Please cite us at Latham, A; Zhang, B J. Chem. Theory Comput. 2021, 17, 3134. (https://pubs.acs.org/doi/abs/10.1021/acs.jctc.0c01220)

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PCCG

Potential Contrasting Coarse-Graining

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chromVAE

variational autoencoder used to analyze chromatin imaging data

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Chrom_cluster

This is the repository of the core scripts for the chromosome clustering project. It includes two individual folders, which is responsible for 1d extrusion and 3d MD simulation, respectively.

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ELP

Code to calculate the surface tension and micropolarity from multiscale simulations of ELP condensates

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TetraNucl

Near-atomistic modeling of tetra-nucleosome

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AWSEM-SAXS

Code to run AWSEM-SAXS simulations

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Explicit_Ion_Chromatin

Lammps Implementation of the Explicit-ion Residue-resolution Chromatin Model

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