相关实验视频

Updated: Jul 10, 2025

A New Straightforward Method for Lipophilicity logP Measurement using 19F NMR Spectroscopy
09:32

A New Straightforward Method for Lipophilicity logP Measurement using 19F NMR Spectroscopy

Published on: January 30, 2019

14.4K

使用COSMO-RS对托烯/水分区系数的盲目预测:来自SAMPL9挑战的结果

Thomas Nevolianis1, Raja A Ahmed1, Arnim Hellweg2

  • 1Institute of Technical Thermodynamics, RWTH Aachen University, 52062 Aachen, Germany. kai.leonhard@ltt.rwth-aachen.de.

Physical chemistry chemical physics : PCCP
|November 21, 2023
PubMed
概括

预测分区系数 (log P) 对于药物设计至关重要. 这项研究使用COSMO-RS和SAMPL9挑战的神经网络,显示出有希望的结果,但强调需要改进溶剂效应建模.

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Resolving Water, Proteins, and Lipids from In Vivo Confocal Raman Spectra of Stratum Corneum through a Chemometric Approach09:32

Resolving Water, Proteins, and Lipids from In Vivo Confocal Raman Spectra of Stratum Corneum through a Chemometric Approach

Published on: September 26, 2019

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In Silico Modeling Method for Computational Aquatic Toxicology of Endocrine Disruptors: A Software-Based Approach Using QSAR Toolbox00:05

In Silico Modeling Method for Computational Aquatic Toxicology of Endocrine Disruptors: A Software-Based Approach Using QSAR Toolbox

Published on: August 28, 2019

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Extraction: Partition and Distribution Coefficients

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Ideal Solutions02:24

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Thin-Layer Chromatography (TLC): Overview01:11

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Thin-layer chromatography (TLC) is a chromatography technique that separates compounds based on their polarity. TLC typically uses polar silica gel, a form of silicon dioxide, as the stationary phase. The silica gel contains hydroxyl (OH) groups on its surface, which form hydrogen bonds with polar compounds, influencing their adhesion to the stationary phase.
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Predicting Reaction Outcomes02:24

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