Search Results - "cheminformatics"

Cheminformatics and its Applications

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Comprehensive characterization of natural products of Polygonum multiflorum by cheminformatics analysis by Xiaowen Hu, Tingting Du, Zhao Wang, Feng Wei, Hua Chen, Shuangcheng Ma

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Development of a cheminformatics platform for selectivity analyses of carbonic anhydrase inhibitors by Giulio Poli, Salvatore Galati, Adriano Martinelli, Claudiu T. Supuran, Tiziano Tuccinardi

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Small molecule drug discovery for glioblastoma treatment based on bioinformatics and cheminformatics approaches by Liya Feng, Sha Zhu, Jian Ma, Jing Huang, Xiaoyan Hou, Qian Qiu, Tingting Zhang, Meixia Wan, Juan Li

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Find novel dual-agonist drugs for treating type 2 diabetes by means of cheminformatics by Liu L, Ma Y, Wang RL, Xu WR, Wang SQ, Chou KC

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Physicochemical Investigation of Psoralen Binding to Double Stranded DNA through Electroanalytical and Cheminformatic Approaches by Douglas Vieira Thomaz, Matheus Gabriel de Oliveira, Edson Silvio Batista Rodrigues, Vinicius Barreto da Silva, Pierre Alexandre dos Santos

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Cheminformatics Bioprospection of Sunflower Seeds' Oils against Quorum Sensing System of <i>Pseudomonas aeruginosa</i> by Nosipho Wendy S'thebe, Jamiu Olaseni Aribisala, Saheed Sabiu

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A cheminformatics and network pharmacology approach to elucidate the mechanism of action of Mycobacterium tuberculosis γ-carbonic anhydrase inhibitors by Ajay Manaithiya, Ratul Bhowmik, Kunal Bhattacharya, Kunal Bhattacharya, Rajarshi Ray, Sagar Singh Shyamal, Fabrizio Carta, Claudiu T. Supuran, Seppo Parkkila, Seppo Parkkila, Ashok Aspatwar

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Exploring G Protein-Coupled Receptors (GPCRs) Ligand Space via Cheminformatics Approaches: Impact on Rational Drug Design by Shaherin Basith, Minghua Cui, Stephani J. Y. Macalino, Jongmi Park, Nina A. B. Clavio, Soosung Kang, Sun Choi

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The effects of cinnamaldehyde and eugenol on human adipose-derived mesenchymal stem cells viability, growth and differentiation: a cheminformatics and in vitro study by Abdorrahim Absalan, Seyed Alireza Mesbah-Namin, Taki Tiraihi, Taher Taheri

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Introduction to the BioChemical Library (BCL): An Application-Based Open-Source Toolkit for Integrated Cheminformatics and Machine Learning in Computer-Aided Drug Discovery by Benjamin P. Brown, Oanh Vu, Alexander R. Geanes, Sandeepkumar Kothiwale, Mariusz Butkiewicz, Edward W. Lowe, Ralf Mueller, Richard Pape, Jeffrey Mendenhall, Jens Meiler, Jens Meiler

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Cheminformatics and biomolecular dynamics studies towards the discovery of anti-staphylococcal nuclease domain-containing 1 (SND1) inhibitors to treat metastatic breast cancer by Nahlah Makki Almansour

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Cheminformatics Identification of Phenolics as Modulators of Penicillin-Binding Protein 2a of <i>Staphylococcus aureus</i>: A Structure-Activity-Relationship-Based Study by Jamiu Olaseni Aribisala, Saheed Sabiu

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A cheminformatics-biophysics correlate to identify promising lead molecules against matrix metalloproteinase-2 (MMP-2) enzyme: A promising anti-cancer target by Faris Alrumaihi

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Navigating bioactivity space in anti-tubercular drug discovery through the deployment of advanced machine learning models and cheminformatics tools: a molecular modeling based retrospective study by Ratul Bhowmik, Ravi Kant, Ajay Manaithiya, Daman Saluja, Bharti Vyas, Ranajit Nath, Kamal A. Qureshi, Seppo Parkkila, Seppo Parkkila, Ashok Aspatwar

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Corrigendum: Navigating bioactivity space in anti-tubercular drug discovery through the deployment of advanced machine learning models and cheminformatics tools: a molecular modeling based retrospective study by Ratul Bhowmik, Ravi Kant, Ajay Manaithiya, Daman Saluja, Bharti Vyas, Ranajit Nath, Kamal A. Qureshi, Seppo Parkkila, Seppo Parkkila, Ashok Aspatwar

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Impacts of Plu kaow (<i>Houttuynia cordata</i> Thunb.) Ethanolic Extract on Diabetes and Dyslipidemia in STZ Induced Diabetic Rats: Phytochemical Profiling, Cheminformatics Analyses, and Molecular Docking Studies by Shaikh Shahinur Rahman, Anuwatchakij Klamrak, Napapuch Nopkuesuk, Jaran Nabnueangsap, Piyapon Janpan, Kiattawee Choowongkomon, Jureerut Daduang, Sakda Daduang

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The Two Faces of Nanomaterials Toxicity and Bioactivity

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Integrative Multi-Omics in Biomedical Research

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Molecular Mechanisms of Leaf Morphogenesis

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