SAM simulation analysis
收藏NIAID Data Ecosystem2026-03-10 收录
下载链接：
https://figshare.com/articles/dataset/SAM_simulation_analysis/5271913
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资源简介：
Analysis of interatomic distances for NOE NMR fitting before and after clustering into individual conformer clusters c1-c6.
Data for 3 different simulations: HF parameterisation, PCM parameterisation and inverted R-S isomer with PCMfitting.
创建时间：
2018-02-21
