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RMSD comparison for each μOR helix embedded in POPC membrane.

NIAID Data Ecosystem2026-03-11 收录

分子动力学模拟

蛋白构象分析

数据链接：

https://figshare.com/articles/dataset/RMSD_comparison_for_each_OR_helix_embedded_in_POPC_membrane_/7847135 数据链接链接失效反馈

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资源简介：

RMSD comparison for each μOR helix embedded in POPC membrane.

应用场景：

创建时间：

2019-03-14

化学反应机理计算

分子动力学模拟

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分子动力学模拟

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MD simulations was performed to validate the stability of the docking pose of radafaxine. The solvated MD system of NET complexed with radafaxine was constructed. Protonation states of residues were a

Figshare2024-08-15 更新10

PDB: 1FSK - Bet v 1-A allergen from birch pollen in complex with mAb BV16: (313K, 40°C, 100 ns) - RMSD, SASA, RMSF, Rg, H-bonds

抗原-抗体相互作用

分子动力学模拟

PDB: 1FSK - Bet v 1-A allergen from birch pollen in complex with mAb BV16: (313K, 40°C, 100 ns) - RMSD, SASA, RMSF, Rg, H-bonds

Harvard Dataverse2024-08-09 更新00

Fraction of near-native FKBP51-FK506 geometries obtained in RP-REMD-DOCK and MD simulations.

蛋白质-配体对接模拟

分子动力学模拟

Fraction of near-native FKBP51-FK506 geometries obtained in RP-REMD-DOCK and MD simulations.

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Pub1-PRE experimental data.zip

蛋白质结构解析

分子动力学模拟

Structure Ensemble of the First Two RNA Recognition Motif Domains of a Poly(U) Binding Protein from Paramagnetic Relaxation Enhancement and Molecular Simulation Guan

Figshare2016-04-21 更新10

RMSD comparison for each μOR helix embedded in POPC membrane.

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