Modeling the Dispersibility of Single Walled Carbon Nanotubes in Organic Solvents by Quantitative Structure-Activity Relationship Approach by Hayriye Yilmaz, Bakhtiyor Rasulev, Jerzy Leszczynski

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QSPR Modeling of the Refractive Index for Diverse Polymers Using 2D Descriptors by Pathan Mohsin Khan, Bakhtiyor Rasulev, Kunal Roy

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A Refractive Index Study of a Diverse Set of Polymeric Materials by QSPR with Quantum-Chemical and Additive Descriptors by Meade E. Erickson, Marvellous Ngongang, Bakhtiyor Rasulev

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A Comprehensive Cheminformatics Analysis of Structural Features Affecting the Binding Activity of Fullerene Derivatives by Natalja Fjodorova, Marjana Novič, Katja Venko, Bakhtiyor Rasulev

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Preparation and Characterization of Inclusion Complexes of <i>β</i>-Cyclodextrin and Phenolics from Wheat Bran by Combination of Experimental and Computational Techniques by Tuba Simsek, Bakhtiyor Rasulev, Christian Mayer, Senay Simsek

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Synthesis of 6-N-R-Tetrazolo[1,5-c]quinazolin-5(6H)-ones and Their Anticancer Activity by Oleksii Mykolayovych Antypenko, Sergiy Kovalenko, Bakhtiyor Rasulev, Jerzy Leszczynski

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TOWARDS MECHANISMS OF NANOTOXICITY – INTERACTION OF GOLD NANOPARTICLES WITH PROTEINS AND DNA by PAWEŁ KRUPA, MAGDALENA A. MOZOLEWSKA, BAKHTIYOR RASULEV, CEZARY CZAPLEWSKI, JERZY LESZCZYNSKI

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MixtureMetrics: A comprehensive package to develop additive numerical features to describe complex materials for machine learning modeling by Rahil Ashtari Mahini, Gerardo Casanola-Martin, Simone A. Ludwig, Bakhtiyor Rasulev

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PRELIMINARY STUDIES OF INTERACTION BETWEEN NANOTUBES AND TOLL-LIKE RECEPTORS by MAGDALENA A. MOZOLEWSKA, PAWEŁ KRUPA, BAKHTIYOR RASULEV, ADAM LIWO, JERZY LESZCZYNSKI

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Structural Features Promoting Photocatalytic Degradation of Contaminants of Emerging Concern: Insights into Degradation Mechanism Employing QSA/PR Modeling by Antonija Tomic, Marin Kovacic, Hrvoje Kusic, Panaghiotis Karamanis, Bakhtiyor Rasulev, Ana Loncaric Bozic

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CombinatorixPy: Advancing mixture descriptors for computational chemistry by Rahil Ashtari Mahini, Gerardo Casanola-Martin, Stephen Szwiec, Simone A. Ludwig, Bakhtiyor Rasulev

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The Hydrolysis Rate of Paraoxonase-1 Q and R Isoenzymes: An In Silico Study Based on In Vitro Data by Sedat Karabulut, Basel Mansour, Gerardo M. Casanola-Martin, Bakhtiyor Rasulev, James W. Gauld

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In Silico Prediction of the Toxicity of Nitroaromatic Compounds: Application of Ensemble Learning QSAR Approach by Amirreza Daghighi, Gerardo M. Casanola-Martin, Troy Timmerman, Dejan Milenković, Bono Lučić, Bakhtiyor Rasulev

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Phenolic Acid–β-Cyclodextrin Complexation Study to Mask Bitterness in Wheat Bran: A Machine Learning-Based QSAR Study by Kweeni Iduoku, Marvellous Ngongang, Jayani Kulathunga, Amirreza Daghighi, Gerardo Casanola-Martin, Senay Simsek, Bakhtiyor Rasulev

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Machine learning analysis of a large set of homopolymers to predict glass transition temperatures by Gerardo M. Casanola-Martin, Anas Karuth, Hai Pham-The, Humbert González-Díaz, Dean C. Webster, Bakhtiyor Rasulev

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Key structural features promoting radical driven degradation of emerging contaminants in water by Matija Cvetnić, Mirjana Novak Stankov, Marin Kovačić, Šime Ukić, Tomislav Bolanča, Hrvoje Kušić, Bakhtiyor Rasulev, Dionysios D. Dionysiou, Ana Lončarić Božić

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How fullerene derivatives (FDs) act on therapeutically important targets associated with diabetic diseases by Natalja Fjodorova, Marjana Novič, Katja Venko, Viktor Drgan, Bakhtiyor Rasulev, Melek Türker Saçan, Safiye Sağ Erdem, Gulcin Tugcu, Alla P. Toropova, Andrey A. Toropov

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Experimental and Simulation Studies on Nonwoven Polypropylene–Nitrile Rubber Blend: Recycling of Medical Face Masks to an Engineering Product by George Varghese P. J, Deepthi Anna David, Anas Karuth, Jabeen Fatima Manamkeri Jafferali, Sabura Begum P. M, Jinu Jacob George, Bakhtiyor Rasulev, Prasanth Raghavan

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Quantitative StructurePermittivity Relationship Study of a Series of Polymers by Yevhenii Zhuravskyi, Kweeni Iduoku, Meade E. Erickson, Anas Karuth, Durbek Usmanov, Gerardo Casanola-Martin, Maqsud N. Sayfiyev, Dilshod A. Ziyaev, Zulayho Smanova, Alicja Mikolajczyk, Bakhtiyor Rasulev

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Carbon Nanotubes’ Effect on Mitochondrial Oxygen Flux Dynamics: Polarography Experimental Study and Machine Learning Models using Star Graph Trace Invariants of Raman Spectra by Michael González-Durruthy, Jose M. Monserrat, Bakhtiyor Rasulev, Gerardo M. Casañola-Martín, José María Barreiro Sorrivas, Sergio Paraíso-Medina, Víctor Maojo, Humberto González-Díaz, Alejandro Pazos, Cristian R. Munteanu

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