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Development of quantitative structure-activity relationship models for vapor pressure estimation using computed molecular descriptors

机译：利用计算分子描述子开发蒸汽压力估算的定量构效关系模型

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Subhash C. Basak; Denise Mills;
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年度 2005
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2. Nano-quantitative structure-activity relationship modeling using easily computable and interpretable descriptors for uptake of magnetofluorescent engineered nanoparticles in pancreatic cancer cells [J] . KarS., GajewiczA., PuzynT., Toxicology in vitro: an international journal published in association with BIBRA . 2014,第4期

机译：使用易于计算和可解释的描述符进行纳米定量结构-活性关系建模，以摄取胰腺癌细胞中的磁荧光工程化纳米颗粒
3. Quantitative structure-activity relationship modeling of polycyclic aromatic hydrocarbon mutagenicity by classification methods based on holistic theoretical molecular descriptors [J] . Paola Gramatica, Ester Papa, Assunta Marrocchi, Ecotoxicology and Environmental Safety . 2007,第3期

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机译：使用RBF网络和进化计算的非线性定量结构关系的发展
5. The development of quantitative structure-activity relationship models for physical property and biological activity prediction of organic compounds. [D] . Mattioni, Brian E. 2003

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6. The Development of Quantitative Structure-Binding Affinity Relationship (QSBR) Models Based on Novel Geometrical Chemical Descriptors of the Protein-Ligand Interfaces [O] . Shuxing Zhang, Alexander Golbraikh, Alexander Tropsha -1

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7. Hierarchical quantitative structure-activity relationships (HiQSARs) for the prediction of physicochemical and toxicological properties of chemicals using computed molecular descriptors [O] . Subhash Basak, Subhabrata Majumdar 2015

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8. Tutorial on Neural Networks Using the Broyden-Fletcher-Goldfarb - Shanno (BFGS) Training Algorithm and Molecular Descriptors with Application to the Prediction of Dielectric Constants through the Development of Quantitative Structure Property Relationships (QSPRs) [R] . Schweitzer, R. C. , Morris, J. B. 2000

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Development of quantitative structure-activity relationship models for vapor pressure estimation using computed molecular descriptors

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