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Computer-aided drug design methodologies toward the design of anti-hepatitis C agents
ReviewAbstract: Hepatitis C constitutes an infectious disease that causes severe damages to the liver, and is causedPalabras claves:3D-QSAR, Anti-HCV agents, Fragments, linear discriminant analysis, QSAR, Structure-based drug designAutores:Alejandro Speck-Planche, Natalia Dias Soeiro Cordeiro M.Fuentes:scopus3D-QSAR methodologies and molecular modeling in bioinformatics for the search of novel anti-HIV therapies: Rational design of entry inhibitors
ReviewAbstract: Human immunodeficiency virus (HIV) is the responsible causal agent of acquired immunodeficiency syndPalabras claves:3D-QSAR, Anti-HIV, CCR5, CXCR4, Fragments, Gp120, Homology modeling, linear discriminant analysis, Molecular docking, QSAR, quantitative contributionsAutores:Alejandro Speck-Planche, Kleandrova V.V., Natalia Dias Soeiro Cordeiro M., Scotti M.T.Fuentes:scopusCurrent computational approaches towards the rational design of new insecticidal agents
ReviewAbstract: Pesticides are chemicals with a great impact in the economy of any country. They are employed for thPalabras claves:3D-QSAR, docking, Fragments, Insecticides, linear discriminant analysis, QSARAutores:Alejandro Speck-Planche, Guilarte-Montero L., Natalia Dias Soeiro Cordeiro M., Yera-Bueno R.Fuentes:scopusAbelson tyrosine-protein kinase 1 as principal target for drug discovery against leukemias role of the current computer-aided drug design methodologies
ArticleAbstract: The discovery of anti-cancer agents is an area which continues in accelerated expansion. Leukemias (Palabras claves:artificial neural networks, Fragments, In silico design, Inhibitors, Kinase, Leukemias, linear discriminant analysis, Molecular docking, QSAR, quantitative contributionsAutores:Alejandro Speck-Planche, Luan F., Natalia Dias Soeiro Cordeiro M.Fuentes:scopusFragment-based QSAR model toward the selection of versatile anti-sarcoma leads
ArticleAbstract: A sarcoma is a type of cancer which is originated from the connective tissue cells. With the time, sPalabras claves:Anti-sarcoma activity, Fragments, linear discriminant analysis, Multi-target QSARAutores:Alejandro Speck-Planche, Kleandrova V.V., Luan F., Natalia Dias Soeiro Cordeiro M.Fuentes:scopusFragment-based approach for the in silico discovery of multi-target insecticides
ArticleAbstract: Pesticides represent extremely useful chemical and biochemical agents for the prevention of crop losPalabras claves:Fragments, Insecticides, linear discriminant analysis, QSAR, quantitative contributionsAutores:Alejandro Speck-Planche, Kleandrova V.V., Scotti M.T.Fuentes:scopusFragment-based in silico modeling of multi-target inhibitors against breast cancer-related proteins
ArticleAbstract: Breast cancer is the most frequent cancer reported in women, being responsible for hundreds of thousPalabras claves:Breast Cancer, design, Fragments, Mtk-computational model, multi-target inhibitor, quantitative contributionsAutores:Alejandro Speck-Planche, Natalia Dias Soeiro Cordeiro M.Fuentes:scopusDiscovery of Anti-Alzheimer agents: Current Ligand-Based approaches toward the design of acetylcholinesterase inhibitors
ArticleAbstract: Alzheimer's disease (AD) is a neurodegenerative disorder characterized by progressive dementia and lPalabras claves:3D-QSAR, AChE inhibitors, Fragments, linear discriminant analysis, QSARAutores:Alejandro Speck-Planche, Luan F., Natalia Dias Soeiro Cordeiro M.Fuentes:scopusMulti-target drug discovery in anti-cancer therapy: Fragment-based approach toward the design of potent and versatile anti-prostate cancer agents
ArticleAbstract: Prostate cancer (PCa) is the second-leading cause of cancer deaths among men in the around the worldPalabras claves:Fragments, linear discriminant analysis, Multi-target QSAR, Prostate cancer, quantitative contributionsAutores:Alejandro Speck-Planche, Kleandrova V.V., Luan F., Natalia Dias Soeiro Cordeiro M.Fuentes:scopusMultitasking Model for Computer-Aided Design and Virtual Screening of Compounds With High Anti-HIV Activity and Desirable ADMET Properties
Book PartAbstract: Human immunodeficiency virus (HIV) is responsible for causing the life-threatening condition known aPalabras claves:Contributions, design, Fragments, Mtk-QSBER, pbkp_rediction, Quadratic Indices, Virtual ScreeningAutores:Alejandro Speck-Planche, Kleandrova V.V.Fuentes:scopus