Coordinate files from: Mapping Structural and Dynamic Divergence Across the MBOAT Family
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https://zenodo.org/record/10622470
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资源简介：
Coordinate files from the first frame of coarse-grained (CG) and atomistic molecular dynamics (MD) simulations of the Membrane Bound O-acyltransferase (MBOAT) family.
MD simulations were run for HHAT, PORCN, GOAT, DltB, ACAT1 and DGAT1. CG simulations were run for 10 x 15 μs. Atomistic simulations were run for 5 x 200 ns.
File description:
Directories for each protein are listed with the suffix CG or atomistic used to indicate the simulation resolution.
md_fit_firstframe_X.gro - GROMACS structure file for the first frame of replicate X.
创建时间：
2024-02-08
