Search Results - "Tetko, I.V."

S-07-03 A snapshot of AI in predictive toxicology: explainable AI by Tetko, I.V.

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Parvalbumin deficiency affects network properties resulting in increased susceptibility to epileptic seizures by Schwaller, B, Tetko, I.V, Tandon, P, Silveira, D.C, Vreugdenhil, M, Henzi, T, Potier, M.-C, Celio, M.R, Villa, A.E.P

“…Networks of GABAergic interneurons are of utmost importance in generating and promoting synchronous activity and are involved in producing coherent…”
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Beware of proper validation of models for ionic Liquids by Makarov, D.M., Fadeeva, Yu.A., Shmukler, L.E., Tetko, I.V.

“…•The traditional validation of ionic liquids models based on random training/test split may overestimate accuracy of models.•A rigorous mixtures validation…”
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Application of Associative Neural Networks for Prediction of Lipophilicity in ALOGPS 2.1 Program by Tetko, Igor V, Tanchuk, Vsevolod Yu

“…This article provides a systematic study of several important parameters of the Associative Neural Network (ASNN), such as the number of networks in the…”
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Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices by Tetko, Igor V, Tanchuk, Vsevolod Yu, Kasheva, Tamara N, Villa, Alessandro E. P

“…The molecular weight and electrotopological E-state indices were used to estimate by Artificial Neural Networks aqueous solubility for a diverse set of 1291…”
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Separation of sequences from host–pathogen interface using triplet nucleotide frequencies by Emmersen, Jeppe, Rudd, Stephen, Mewes, Hans-Werner, Tetko, Igor V.

“…The identification of genes involved in host–pathogen interactions is important for the elucidation of mechanisms of disease resistance and host…”
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Different tonic regulation of neuronal activity in the rat dorsal raphe and medial prefrontal cortex via 5-HT1A receptors by HAJOS, M, HOFFMANN, W. E, TETKO, I. V, HYLAND, B, SHARP, T, VILLA, A. E. P

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Different tonic regulation of neuronal activity in the rat dorsal raphe and medial prefrontal cortex via 5-HT 1A receptors by Hajós, M., Hoffmann, W.E., Tetko, I.V., Hyland, B., Sharp, T., Villa, A.E.P.

“…It has been established that 5-HT 1A receptors are expressed both presynaptically as autoreceptors by 5-HT containing neurones, and postsynaptically by a…”
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Dopamine modulation of glutamate metabotropic receptors in conditioned reaction of sensory motor cortex neurons of the cat by Storozhuk, V.M, Khorevin, V.I, Rozumna, N.M, Villa, A.E.P, Tetko, I.V

“…The dopamine modulation of microiontophoretic application of antagonists of glutamate metabotropic synaptic transmission was studied in the sensory motor…”
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Dopamine modulation of activity of cat sensorimotor cortex neurons during conditioned reflexes by Storozhuk, V.M, Khorevin, V.I, Rozumna, N.M, Villa, A.E.P, Tetko, I.V

“…The effects of iontophoretic application of dopamine and selective D1 or D2 dopamine receptor agonists and antagonists on impulse activity of neurons of the…”
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Electronic-Topological Investigation of theStructure - Acetylcholinesterase Inhibitor Activity Relationship in the Series of N-Benzylpiperidine Derivatives by Dimoglo, A.S., Shvets, N.M., Tetko, I.V., Livingstone, D.J.

“…“Structure – acetylcholinesterase (AChE) inhibitor activity” relationship studies have been performed for three series of N‐benzylpiperidine derivatives using…”
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Evaluation of potential HIV-1 reverse transcriptase inhibitors by artificial neural networks by Tetko, I.V., Tanchuk, V.Yu, Luik, A.I.

“…Artificial neural networks were used to analyze the human immunodeficiency virus type 1 reverse transcriptase inhibitors and to evaluate newly synthesized…”
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Simple heuristic methods for input parameters' estimation in neural networks by Tetko, I.V., Tanchuk, V.Yu, Luik, A.I.

“…We propose simple heuristic methods that can evaluate the relevance of input parameters after completing neural network training. Besides that, these methods…”
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