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Source data for "Synthesis of a glycan hairpin"

B2FIND2026-04-29 收录

糖类合成

分子建模

数据链接：

https://b2find.eudat.eu/dataset/9c110432-63e6-51e5-a163-adfa456ede91 数据链接链接失效反馈

官方服务：

资源简介：

experimental; simulation/modelling

应用场景：

DNA纳米结构

分子建模

The structure_file for simulating DNA and the DNase I-DNA complex as mentioned in the article; the simulation_parameters:** Access the simulation parameters (in mdp format) and bond parameters (in itp

DataCite Commons2023-12-01 更新140

Gaussian Job Archive for C7H16O3

量子化学计算

分子建模

Archive of work produced using the resources of the Imperial College High Performance Computing Service.

NIAID Data Ecosystem60

Phenylacetic acid/p-Me-Benzylamine amide monomer, 3a, B3LYP+GD3BJ/Def2-TZVPP, Toluene, iso G =-750.091192 Temp=383.85

量子化学

分子建模

Gaussian 16 (C01) calculation

DataCite Commons2025-05-03 更新60

Gaussian Job Archive for C144H144(2+)

量子化学计算

分子建模

Archive of work produced using the resources of the Imperial College High Performance Computing Service.

NIAID Data Ecosystem70

GEMC simulation results

热力学模拟

分子建模

Perturbation terms to the Helmholtz energy computed from GEMC simulations.

DataCite Commons2026-03-16 更新60

Source data for "Synthesis of a glycan hairpin"

资源简介：

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