Simple Method (CHEM-SP) to Predict Solubility from 2‑D Chemical Structures
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下载链接:
https://figshare.com/articles/dataset/Simple_Method_CHEM-SP_to_Predict_Solubility_from_2_D_Chemical_Structures/13488244
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资源简介:
Computerized
Human Expert Method for Solubility Prediction (CHEM-SP)
is a simple method that can be used to predict solubility in water
and organic solvents, from two-dimensional (2-D) chemical structures
in conjunction with a reference solubility library. Compared to other
solubility prediction models, it is very simple to execute and produces
results that are equivalent or better.
创建时间:
2020-12-24



