首页/数据集/MD values of peptides LSNRAAFFR and TNEDPYTIDVES complexed with ERK1.

MD values of peptides LSNRAAFFR and TNEDPYTIDVES complexed with ERK1.

NIAID Data Ecosystem2026-05-10 收录

数据链接：

https://figshare.com/articles/dataset/MD_values_of_peptides_LSNRAAFFR_and_TNEDPYTIDVES_complexed_with_ERK1_/30180878 数据链接链接失效反馈

官方服务：

资源简介：

MD values of peptides LSNRAAFFR and TNEDPYTIDVES complexed with ERK1.

应用场景：

创建时间：

2025-09-22

相关数据集

Table5.csv

抗菌肽理性设计

分子动力学模拟

Antimicrobial peptides (AMPs) are gaining attention as substitutes for antibiotics in order to combat the risk posed by multi-drug resistant pathogens. Several research groups are engaged in design of

NIAID Data Ecosystem40

Atomistic Fingerprint Of Hyaluronan-Cd44 Binding: Unbound Simulations, Set 2

分子动力学模拟

蛋白质-多糖相互作用

Simulation files (Gromacs 4.6.7 format) for the "Unbound" simulations in Ref. [1]. There are two replicas marked with "_4" and "_5". Files include: -trajectories (.xtc) that are saved every 100ps <

Zenodo2020-09-18 更新00

Average times between folding-unfolding transitions in different confinements for investigated knotted (MJ0366, MJ036_CC, VirC2, DndE), and unknotted (AvtR) proteins.

蛋白质折叠与解折叠动力学

分子动力学模拟

Times are given in simulation steps and divided by 106.

Figshare2017-05-11 更新00

DataSheet1_Caging Polycations: Effect of Increasing Confinement on the Modes of Interaction of Spermidine3+ With DNA Double Helices.PDF

DNA相互作用

分子动力学模拟

Polyamines have important roles in the modulation of the cellular function and are ubiquitous in cells. The polyamines putrescine2+, spermidine3+, and spermine4+ represent the most abundant organic co

NIAID Data Ecosystem10

Development of molecular dynamics-based features from all-atom simulations of αGAL mutants to assess pharmacoperone responsiveness

分子动力学模拟

法布里病药物开发

MD trajectories of wild type, N215S and R301Q α-galactosidase A (αGAL). Defects of this protein lead to the development of Fabry disease, a multi systemic disease caused by the lysosomal accumulation

Zenodo2026-04-02 更新00