Search Results - "Grigor’ev, Veniamin Yu"
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Calculation of Aqueous Solubility of Crystalline Un-Ionized Organic Chemicals and Drugs Based on Structural Similarity and Physicochemical Descriptors
Published in Journal of chemical information and modeling (24-02-2014)“…Solubilities of crystalline organic compounds calculated according to AMP (arithmetic mean property) and LoReP (local one-parameter regression) models based on…”
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Classification and Quantification of the Toxicity of Chemicals to Guppy, Fathead Minnow and Rainbow Trout: Part 1. Nonpolar Narcosis Mode of Action
Published in QSAR & combinatorial science (01-12-2008)“…Discrimination of the acute toxicity of chemicals to guppy (Poecilia reticulata), fathead minnow (Pimephales promelas) and rainbow trout (Oncorhynchus mykiss)…”
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Classification and Quantification of the Toxicity of Chemicals to Guppy, Fathead Minnow, and Rainbow Trout. Part 2. Polar Narcosis Mode of Action
Published in QSAR & combinatorial science (01-02-2009)“…This paper is devoted to the classification of chemicals with polar narcosis Mode of Action (MOA) to guppy, fathead minnow and rainbow trout, and to creation…”
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In silico Prediction of Aqueous Solubility: a Comparative Study of Local and Global Predictive Models
Published in Molecular informatics (01-06-2015)“…32 Quantitative Structure‐Property Relationship (QSPR) models were constructed for prediction of aqueous intrinsic solubility of liquid and crystalline…”
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