„docking“

Suchergebnisse

7.903 Treffer

• Combined approach of homology modeling, molecular dynamics, and docking: computer-aided drug discovery
  Chahal, Varun ; Nirwan, Sonam ; Kakkar, Rita
• Combinatorial library design and virtual screening of cryptolepine derivatives against topoisomerase IIA by molecular docking and DFT studies
  Maria ; Khan, Zahid ; Kuznetsov, Aleksey E.
• Mechanistic insight into the interactions between thiazolidinedione derivatives and PTP-1B combining 3D QSAR and molecular docking in the treatment of type 2 diabetes
  Igunnu, Adedoyin ; Ambrose, George Oche ; Adigun, Temidayo Olamide
• Theoretical investigation of the derivatives of favipiravir (T-705) as potential drugs for Ebola virus
  Rhyman, Lydia ; Tursun, Mahir ; Abdallah, Hassan H. ; Choong, Yee Siew ; Parlak, Cemal ; Kharkar, Prashant ; Ramasami, Ponnadurai
• Correction to: Evaluation of affinity of bioactive isolates from various coffee extracts through binding with PPAR‐γ with the use of isothermal titration calorimetry and docking simulation to prevent antidiabetic effects
  Grzelczyk, Joanna ; Budryn, Grażyna ; Pérez‐Sánchez, Horacio
• Correction to: Exploration for novel inhibitors showing back-to-front approach against VEGFR-2 kinase domain (4AG8) employing molecular docking mechanism and molecular dynamics simulations
  Rampogu, Shailima ; Baek, Ayoung ; Zeb, Amir ; Lee, Keun Woo
• Correction to: Synthesis, molecular docking, and apoptogenic efficacy of novel N-heterocycle analogs to target B-cell lymphoma 2/X-linked inhibitors of apoptosis proteins to regress melanoma
  Zabiulla ; Malojirao, Vikas H. ; Mohammed, Yasser Hussein Eissa ; Thirusangu, Prabhu ; Prabhakar, B. T. ; Khanum, Shaukath Ara
• Correction to: Prediction of the sorption coefficient for the adsorption of PAHs on MWCNT based on hybrid QSPR-molecular docking approach
  Yali, Zahra Pahlavan ; Fatemi, Mohammad H.
• In Vitro Anti-Leishmanial Activity and Molecular Docking of Eugenol as a Potential Agent Against Leishmania Major
  Mohamadi, Neda ; Karimi, Shiva ; Sharififar, Fariba ; Salarkia, Ehsan ; Sharifi, Fatemeh
• Genomic insights, determination of quorum quenching potential of a beta-lactamase enzyme from Chromohalobacter sp. strain D23 against Aeromonas hydrophila and molecular docking study
  Ghosh, Dhritishree ; Alam, Sk Aftabul ; Mukhopadhyay, Subhra Kanti
• Trimethoxyphenyl-1,2,4-triazol-3-ones: synthesis, characterization, DFT, antimicrobial and acetylcholinesterase inhibitory activities with molecular docking and dynamics studies
  Ünver, Yasemin ; Çelik, Fatih ; Güler, Halil İbrahim ; Bektaş, Kadriye İnan ; Süleymanoğlu, Nevin ; Ustabaş, Reşat
• β-Lactam Potentiating Activity, Molecular Docking, and ADMET Analysis of 3-Substituted Coumarins
  Araújo-Neto, José B. de ; Alves, Daniel S. ; Araújo, Gildênia A. de ; Ribeiro, Fernanda R. ; Brancaglion, Guilherme A. ; Carvalho, Diogo T. ; Coutinho, Henrique D. M. ; Schrank, Augusto ; Tintino, Saulo R.
• Double-layer PVA/chitosan-based curcumin-coated zinc oxide biofunctional wound dressing: GC–MS analysis, antimicrobial effect, molecular docking, and cytotoxicity evaluation
  Soylu, Zelal ; Oktay, Büşra ; Ceylan Erdoğan, Duygu ; Ari Yuka, Selcen ; Ciftci, Fatih ; Erarslan, Azime ; Ahlatcıoglu Özerol, Esma
• Methodenhandbuch der Betriebswirtschaft
  Nagel, Michael ; Mieke, Christian ; Teuber, Stephan 2025 UVK
• Erratum to: “Overexpression, Homology Modeling and Coenzyme Docking Studies of the Cytochrome P450nor2 from Cylindrocarpon tonkinense” [Molecular Biology 50, 320 (2016)]
  Li, N. ; Zhang, Y. Z. ; Li, D. D. ; Niu, Y. H. ; Liu, J. ; Li, S. X. ; Yuan, Y. Z. ; Chen, S. L. ; Geng, H. ; Liu, D. L.
• Correction to: Antiacetylcholinesterase activity and docking studies with chlorogenic acid, cynarin and arzanol from Helichrysum stoechas (Asteraceae)
  Silva, Letícia ; Rodrigues, Ana Margarida ; Ciriani, Marina ; Falé, Pedro Luis Vieira ; Teixeira, Vitor ; Madeira, Paulo ; Machuqueiro, Miguel ; Pacheco, Rita ; Florêncio, Maria Helena ; Ascensão, Lia ; Serralheiro, Maria Luísa Marques
• Author Correction: Structure-function relationships in ABCG2: insights from molecular dynamics simulations and molecular docking studies
  Ferreira, Ricardo J. ; Bonito, Cátia A. ; Cordeiro, M. Natália D. S. ; Ferreira, Maria-José U. ; Santos, Daniel J. V. A. dos
• Correction to: Design, synthesis, conformational and molecular docking study of some novel acyl hydrazone based molecular hybrids as antimalarial and antimicrobial agents
  Kumar, Parvin ; Kadyan, Kulbir ; Duhan, Meenakshi ; Sindhu, Jayant ; Singh, Vineeta ; Saharan, Baljeet Singh
• Correction to: Malachite Green and Crystal Violet Decolorization by Ganoderma lucidum and Pleurotus ostreatus Supernatant and by rGlLCC1 and rPOXA 1B Concentrates: Molecular Docking Analysis
  Morales-Álvarez, Edwin D. ; Rivera-Hoyos, Claudia M. ; Poveda-Cuevas, Sergio A. ; Reyes-Guzman, Edwin A. ; Pedroza-Rodríguez, Aura M. ; Reyes-Montaño, Edgar A. ; Poutou-Piñales, Raúl A.
• Exploring Chalcone Derivatives Against Alzheimer’s Disease: Biological Activity and Structure–Activity Relationships
  Prabha, Shashi ; Rajput, Sobhit Singh