Alarms about structural alerts von Alves, Vinicius, Muratov, Eugene, Capuzzi, Stephen, Politi, Regina, Low, Yen, Braga, Rodolpho, Zakharov, Alexey V, Sedykh, Alexander, Mokshyna, Elena, Farag, Sherif, Andrade, Carolina, Kuz'min, Victor, Fourches, Denis, Tropsha, Alexander

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Application of Random Forest Approach to QSAR Prediction of Aquatic Toxicity von Polishchuk, Pavel G, Muratov, Eugene N, Artemenko, Anatoly G, Kolumbin, Oleg G, Muratov, Nail N, Kuz’min, Victor E

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QSAR Modeling: Where Have You Been? Where Are You Going To? von Cherkasov, Artem, Muratov, Eugene N, Fourches, Denis, Varnek, Alexandre, Baskin, Igor I, Cronin, Mark, Dearden, John, Gramatica, Paola, Martin, Yvonne C, Todeschini, Roberto, Consonni, Viviana, Kuz’min, Victor E, Cramer, Richard, Benigni, Romualdo, Yang, Chihae, Rathman, James, Terfloth, Lothar, Gasteiger, Johann, Richard, Ann, Tropsha, Alexander

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QSAR Modeling and Prediction of Drug–Drug Interactions von Zakharov, Alexey V, Varlamova, Ekaterina V, Lagunin, Alexey A, Dmitriev, Alexander V, Muratov, Eugene N, Fourches, Denis, Kuz’min, Victor E, Poroikov, Vladimir V, Tropsha, Alexander, Nicklaus, Marc C

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Universal Approach for Structural Interpretation of QSAR/QSPR Models von Polishchuk, Pavel G., Kuz'min, Victor E., Artemenko, Anatoly G., Muratov, Eugene N.

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Interpretation of QSAR Models Based on Random Forest Methods von Kuz'min, Victor E., Polishchuk, Pavel G., Artemenko, Anatoly G., Andronati, Sergey A.

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Design, Virtual Screening, and Synthesis of Antagonists of αIIbβ3 as Antiplatelet Agents von Polishchuk, Pavel G., Samoylenko, Georgiy V., Khristova, Tetiana M., Krysko, Olga L., Kabanova, Tatyana A., Kabanov, Vladimir M., Kornylov, Alexander Yu, Klimchuk, Olga, Langer, Thierry, Andronati, Sergei A., Kuz’min, Victor E., Krysko, Andrei A., Varnek, Alexandre

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The effects of characteristics of substituents on toxicity of the nitroaromatics: HiT QSAR study von Kuz’min, Victor E., Muratov, Eugene N., Artemenko, Anatoly G., Gorb, Leonid, Qasim, Mohammad, Leszczynski, Jerzy

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Application of Quantum Chemical Approximations to Environmental Problems: Prediction of Water Solubility for Nitro Compounds von Kholod, Yana A, Muratov, Eugene N, Gorb, Leonid G, Hill, Frances C, Artemenko, Anatoly G, Kuz’min, Victor E, Qasim, Mohammad, Leszczynski, Jerzy

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Application of Random Forest and Multiple Linear Regression Techniques to QSPR Prediction of an Aqueous Solubility for Military Compounds von Kovdienko, Nikolay A., Polishchuk, Pavel G., Muratov , Eugene N., Artemenko, Anatoly G., Kuz'min, Victor E., Gorb, Leonid, Hill, Frances, Leszczynski , Jerzy

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QSPR Models for Predicting of the Melting Points and Refractive Indices for Inorganic Substances: Components of the Optical Film-Forming Materials von Shyrykalova, Angela O, Kuz'min, Victor E, Ognichenko, Liudmila N, Zinchenko, Viktor F, Artemenko, Anatoly G, Kozhukhar, Anna V

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The effect of the structure of derivatives of nitrogen-containing heterocycles on their anti-influenza activity von Gridina, Tatyana L., Fedchuk, Alla S., Basok, Stephan S., Artemenko, Anatoliy G., Ognichenko, Liudmila N., Shitikova, Larisa I., Lutsyuk, Anatolii F., Gruzevskii, Aleksandr A., Kuz’min, Victor E.

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New QSPR equations for prediction of aqueous solubility for military compounds von Muratov, Eugene N., Kuz’min, Victor E., Artemenko, Anatoly G., Kovdienko, Nikolay A., Gorb, Leonid, Hill, Frances, Leszczynski, Jerzy

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Existing and Developing Approaches for QSAR Analysis of Mixtures von Muratov, Eugene N., Varlamova, Ekaterina V., Artemenko, Anatoly G., Polishchuk, Pavel G., Kuz'min, Victor E.

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Hierarchic system of QSAR models (1D-4D) on the base of simplex representation of molecular structure von Kuz'min, Victor E, Artemenko, Anatoly G, Polischuk, Pavel G, Muratov, Eugene N, Hromov, Alexander I, Liahovskiy, Anatoly V, Andronati, Sergey A, Makan, Svetlana Yu

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Causal inference methods to assist in mechanistic interpretation of classification nano-SAR models von Sizochenko, Natalia, Rasulev, Bakhtiyor, Gajewicz, Agnieszka, Mokshyna, Elena, Kuz'min, Victor E., Leszczynski, Jerzy, Puzyn, Tomasz

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Quantitative structure-activity relationship modelling of influenza M2 ion channels inhibitors von Stankova, Ivanka, Chayrov, Radoslav, Schmidtke, Michaela, Danalev, Dancho, Ognichenko, Liudmila, Artemenko, Anatoly, Shapkin, Valery, Kuz'min, Victor

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Anti-enteroviral activity of new MDL-860 analogues: Synthesis, in vitro/in vivo studies and QSAR analysis von Nikolova, Ivanka, Slavchev, Ivaylo, Ravutsov, Martin, Dangalov, Miroslav, Nikolova, Yana, Zagranyarska, Irena, Stoyanova, Adelina, Nikolova, Nadya, Mukova, Lucia, Grozdanov, Petar, Nikolova, Rosica, Shivachev, Boris, Kuz'min, Victor E., Ognichenko, Liudmila N., Galabov, Angel S., Dobrikov, Georgi M.

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Quantitative Structure−Activity Relationship Studies of [(Biphenyloxy)propyl]isoxazole Derivatives. Inhibitors of Human Rhinovirus 2 Replication von Kuz'min, Victor E, Artemenko, Anatoly G, Muratov, Eugene N, Volineckaya, Ingrid L, Makarov, Vadim A, Riabova, Olga B, Wutzler, Peter, Schmidtke, Michaela

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Computational assessment of environmental hazards of nitroaromatic compounds: influence of the type and position of aromatic ring substituents on toxicity von Tinkov, Oleg V., Ognichenko, Luidmila N., Kuz’min, Victor E., Gorb, Leonid G., Kosinskaya, Anna P., Muratov, Nail N., Muratov, Eugene N., Hill, Frances C., Leszczynski, Jerzy

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