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Top 3 binding affinities after three-point mutations.
Top 3 binding affinities after three-point mutations.
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Figshare
2024-10-22 更新
2026-04-28 收录
结合亲和力
点突变效应分析
数据链接：
https://figshare.com/articles/dataset/Top_3_binding_affinities_after_three-point_mutations_/27278592
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资源简介：
Top 3 binding affinities after three-point mutations.
应用场景：
创建时间：
2024-10-22
相关数据集
introvoyz041/binding_512_SELFIES
分子结构
结合亲和力
--- dataset_info: features: - name: seq dtype: string - name: smiles dtype: string - name: affinity_uM dtype: float64 - name: neg_log10_affinity_M dtype: float64 - name: sm
Hugging Face
2026-01-05 更新
5
0
Dissociation constants (µM) for interaction of various BPTI species with PDI.
代谢物-蛋白相互作用
结合亲和力
The results shown are duplicate individual determinations obtained by surface plasmon resonance.
NIAID Data Ecosystem
5
0
Docking scores (kcal/mol) for the 2W99 complex were determined using AutoDock Vina.
分子对接
结合亲和力
Docking scores (kcal/mol) for the 2W99 complex were determined using AutoDock Vina.
Figshare
2025-08-22 更新
3
0
Resorcin[4]arene-based multidentate phosphate ligands with superior binding affinity for nanocrystal surfaces
纳米晶表面修饰
结合亲和力
Data underlying the figures in the publication “Resorcin[4]arene-based multidentate phosphate ligands with superior binding affinity for nanocrystal surfaces”, published in Chemical Communications
Zenodo
2021-04-20 更新
5
0
MM-GBSA binding affinity results for the selected compounds.
药物分子模拟
结合亲和力
MM-GBSA binding affinity results for the selected compounds.
NIAID Data Ecosystem
3
0
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