Supplementary Material

NIAID Data Ecosystem2026-05-02 收录

纳米棒自组装

粗粒度分子动力学

数据链接：

https://figshare.com/articles/dataset/Supplementary_Material/28774451 数据链接链接失效反馈

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资源简介：

Additional details on coarse-grained model used, formation of crystals of nanorods, structural and dynamical properties.

创建时间：

2025-05-05

Coarse-grained ssDNA with Dissipative Particle Dynamics

粗粒度分子动力学

单链DNA分析

This dataset accompanies the poster “Coarse-grained ssDNA with Dissipative Particle Dynamics,” presented at the 19th Doctoral Days of the Nanoscience, Materials, and Chemical...

B2FIND110

Coarse-Grained Molecular Dynamics Simulation Dataset for Peptide-Lipid Interaction

肽-脂质相互作用

粗粒度分子动力学

This dataset contains the coarse-grained molecular dynamics simulations used to analyze peptide-lipid interactions using the Martini 3 force field. The system was constructed and coarse-grained follow

Zenodo2025-12-09 更新40

Anisotropic force-matching coarse-graining with neural networks data files

粗粒度分子动力学

力场参数机器学习优化

Simulation files for all-atom simulation of benzene. neural network architecture

DataCite Commons2022-09-27 更新30

Project files provided as supporting information to the manuscript "Kinetics of radiation-induced DNA double-strand breaks through coarse-grained simulations"

DNA损伤动力学模拟

粗粒度分子动力学

README file to the project files provided as supporting information to the manuscript “Kinetics of radiation-induced DNA double-strand breaks through coarse-grained simulations" Autho

Zenodo2023-05-16 更新50

Predicting the Spurious Acceleration of Coarse-Grained Molecular Dynamics from Molecular Fluid Structure

粗粒度分子动力学

分子迁移率加速预测

Reproducing dynamical properties, such as diffusion coefficients, in coarse-grained (CG) molecular dynamics simulations can be challenging due to the loss of fine-grained details, such as atomic vibra

Figshare2025-02-22 更新30

Supplementary Material

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