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[1]
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Assessment of iridoids and their similar structures as antineoplastic drugs by in silico approach
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Journal of Biomolecular …,
2024 |
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[2]
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Molecular interaction and MD-simulations: investigation of Sizofiran as a promising anti-cancer agent targeting eIF4E in colorectal cancer
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In Silico Pharmacology,
2024 |
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[3]
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Insights on molecular modeling and supramolecular arrangement of bilastine polymorphs
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Journal of Molecular …,
2024 |
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[4]
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In silico exploration of potent flavonoids for dengue therapeutics
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bioRxiv,
2024 |
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[5]
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Identification of Therapeutic Leads from Ficus hispida Fruit Phytochemicals against Prostate Cancer Using Pharmacoinformatic and Molecular Dynamics Simulation …
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bioRxiv,
2023 |
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[6]
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Exploration of Anti-Diabetic Potential of Rubus ellipticus Smith through Molecular Docking, Molecular Dynamics Simulation, and MMPBSA Calculation
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Journal of Nepal …,
2023 |
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[7]
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A Computational Approach for Structural and Functional Analyses of Disease-associated Mutations in the Human CYLD Gene
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bioRxiv,
2023 |
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[8]
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Molecular docking and molecular dynamics simulation-based identification of natural inhibitors against druggable human papilloma virus type 16 target
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Trends in …,
2023 |
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[9]
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DSF inactivator RpfB homologous FadD upregulated in Bradyrhizobium japonicum under iron limiting conditions
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Scientific Reports,
2023 |
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[10]
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Multifaceted mutational immunotherapeutic approach to design therapeutic mAbs to combat monkeypox disease via integrated screening algorithms and antibody …
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… Systems Design & …,
2023 |
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[11]
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Unraveling the Role of Hydrogen Bonds in Thrombin via Two Machine Learning Methods
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Journal of Chemical Information and …,
2023 |
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[12]
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Inhibition potential of natural flavonoids against selected omicron (B. 1.19) mutations in the spike receptor binding domain of SARS-CoV-2: a molecular modeling …
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Journal of …,
2023 |
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[13]
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Discovery of new chemotypes of dual 5-HT2A/D2 receptor antagonists with a strategy of drug design methodologies
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Future Medicinal Chemistry,
2022 |
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[14]
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An In Silico investigation for acyclovir and its derivatives to fight the COVID-19: Molecular docking, DFT calculations, ADME and td-Molecular dynamics simulations
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Journal of the Indian …,
2022 |
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[15]
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Sequential pattern mining on chemical bonding database in the bioinformatics field
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AIP Conference …,
2022 |
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[16]
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Molecular Docking and Dynamics Simulation Studies to Predict Multiple Medicinal Plants' Bioactive Compounds Interaction and Its Behavior on the Surface of DENV-2 …
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… Journal of Modern …,
2022 |
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[17]
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In Silico study for acyclovir, ganciclovir and its derivatives to fight the COVID-19: Molecular docking, DFT calculations, ADME and td-Molecular dynamics simulations
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Journal of the Indian …,
2022 |
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[18]
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Comparison of antiviral effect of camel lactoferrin peptide (CLF36) and new generation drugs against hepatitis C virus
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Agricultural …,
2022 |
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[19]
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In Silico Study for Acyclovir and Its Derivatives Against Mpro of nCoV: Temperature Dependent Molecular Dynamics Simulations
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2022 |
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[20]
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مقایسه اثر ضد ویروسی پپتید لاکتوفرین شتری (CLF36) و داروهای نسل جدید بر علیه ویروس هپاتیت C
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مجله بیوتکنولوژی کشاورزی,
2022 |
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[21]
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Integrated approach for studying bioactive compounds from Cladosporium spp. against estrogen receptor alpha as breast cancer drug target
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Scientific Reports,
2022 |
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[22]
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Određivanje strukture farmakofore, dizajn i in vitro ispitivanje liganada sa višestrukim dejstvom kao potencijalno efikasnijih terapeutika složenih neuroloških i …
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Универзитет у Београду,
2022 |
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[23]
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و داروهای نسل جدید بر علیه) CLF مقایسه اثر ضد ویروسی پپتید لاکتوفرین شتری) 36 C ویروس هپاتیت
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Agricultural …,
2022 |
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[24]
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پیش بینی اپی توپ های انتی ژن های omp25 و BLS باکتری بروسال و برهمکنش آنها با مولکولهای MHC در گوسفند به روش بیوانفورماتیکی.
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Agricultural …,
2022 |
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[25]
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Prediction of Brucella Omp25 and BLS antigens epitopes and their interaction with MHC molecules in sheep by in silico methods.
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2021 |
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[26]
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Prediction of Brucella omp25 and BLS antigens epitopes and their interaction with MHC molecules in sheep by in silico methods
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Agricultural …,
2021 |
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[27]
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Drug design targeting active posttranslational modification protein isoforms
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2021 |
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[28]
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Rational design of hyper-glycosylated human follicle-stimulating hormone analogs (a bioinformatics approach)
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2021 |
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[29]
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Examples of Practical Application
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Decision Tree and Ensemble Learning Based on Ant Colony Optimization,
2019 |
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[30]
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Assessment of Drug Binding Potential of Pockets in the NS2B/NS3 Dengue Virus Protein
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IOP Conference Series: Materials Science and Engineering,
2018 |
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[31]
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Salient Structural Features of Human Lemur Tyrosine Kinase 3 (LMTK3) Domain from Molecular Dynamics Simulation Study
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Current Biotechnology,
2018 |
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[32]
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The Thermo Stability of Lipase: Salt Bridge and Salt Bridge Network Perspective Based on Long Time Molecular Dynamics Simulation
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2017 |
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[33]
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The Relation Between Lipase Thermostability and Dynamics of Hydrogen Bond and Hydrogen Bond Network Based on Long Time Molecular Dynamics Simulation
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Protein and Peptide Letters,
2017 |
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[34]
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SNP mutations occurring in thyroid hormone receptor influenced individual susceptibility to triiodothyronine: Molecular dynamics and site‐directed mutagenesis …
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Journal of Cellular Biochemistry,
2017 |
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[35]
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Probabilistic Deterministic Classifier Based Sequential Pattern Mining to Evaluate Structural Pattern on Chemical Bonding
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International Journal of Computer Science Trends and Technology,
2016 |
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[36]
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Exploring the structural constraints at cleavage site of mucin 1 isoform through molecular dynamics simulation
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European Biophysics Journal,
2015 |
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[37]
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Computational analysis of C-reactive protein for assessment of molecular dynamics and interaction properties
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Cell biochemistry and biophysics,
2013 |
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[38]
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Conformational dynamics of xylanase a from Streptomyces lividans: Implications for TIM‐barrel enzyme thermostability
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Biopolymers,
2013 |
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[39]
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Dynamic Version of the ACDT/ACDF Algorithm for H-Bond Data Set Analysis
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Computational Collective Intelligence. Technologies and Applications,
2013 |
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[40]
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Mapping the Structural Topology of IRS Family Cascades Through Computational Biology
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Cell biochemistry and biophysics,
2013 |
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[41]
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Sampling‐based exploration of folded state of a protein under kinematic and geometric constraints
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Proteins: Structure, Function, and Bioinformatics,
2012 |
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[42]
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Использование градиентного бустинга деревьев решений для предсказания стабильности водородной связи в белке
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2011 |
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[43]
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PHARMACOPHORE ANALYSIS, DESIGN AND IN VITRO TESTING OF MULTI-TARGET LIGANDS AS POTENTIALLY EFFECTIVE THERAPEUTICS OF …
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