RNN features.

Figshare2018-09-04 更新2026-04-29 收录

循环神经网络特征工程

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数据链接：

https://figshare.com/articles/dataset/RNN_features_/7044137 数据链接链接失效反馈

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Table lists the feature name, the descriptor that produced the feature and the reference for the descriptor.

创建时间：

2018-09-04

QDB archive #64

毒力预测

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This QDB archive contains data from the following publication: Kaiser, K.L.; Niculescu, S.P.; Schultz, T.W. Probabilistic neural network modeling of the toxicity of chemicals to Tetrahymena pyriformis

DataCite Commons2020-10-10 更新230

Descriptors list full AlvaDesc

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化学信息学

A comprehensive set of molecular descriptors was calculated using AlvaDesc, including physicochemical, topological, geometrical, and surface-related parameters.

Zenodo2026-04-27 更新50

Meanings of the robust descriptors influencing significantly the CP-response of peptides.

计算肽化学

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1Weighted Holistic Invariant Molecular descriptors. 23D-Molecular Representation of Structures based on Electron diffraction.

NIAID Data Ecosystem40

Performances of the optimized SVM models with MOE and IE descriptors on the training set (cross-validation CV) and the external validation set.

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SVM支持向量机

Performances of the optimized SVM models with MOE and IE descriptors on the training set (cross-validation CV) and the external validation set.

NIAID Data Ecosystem70

MOESM7 of Feature optimization in high dimensional chemical space: statistical and data mining solutions

药物化学特征工程

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Additional file 7: Table S10. Weighted burden number descriptor values (PCAD) of FDA approved drugs and that of PubChem molecules which were enlisted in TableÂ 3.

Figshare2018-07-13 更新40

RNN features.

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