Impact of glutamate carboxylation in the adsorption of the alpha-1 domain of osteocalcin to hydroxyapatite and titania

Name: Impact of glutamate carboxylation in the adsorption of the alpha-1 domain of osteocalcin to hydroxyapatite and titania
Creator: Materials Cloud
Published: 2020-06-22T18:00:24+08:00

DataCite Commons2026-03-12 更新2025-04-16 收录

分子动力学模拟

生物材料表面相互作用

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https://archive.materialscloud.org/doi/10.24435/materialscloud:3t-b1 数据链接链接失效反馈

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资源简介：

This record contains files necessary to reproduce enhanced sampling well-tempered metadynamics (wtMTD) and parallel tempering metadynamics in the well-tempered ensemble (PT-MetaD-WTE) simulations in PLUMED using GROMACS 2018.3.

提供机构：

Materials Cloud

创建时间：

2020-06-22