„docking“

Suchergebnisse

7.903 Treffer

• Metabolic behavior prediction of pazopanib by cytochrome P450 (CYP) 3A4 by molecular docking
  Liu, Xing-Jie ; Lu, Hua ; Sun, Ju-Xiang ; Wang, Su-Rong ; Mo, Yan-Shuai ; Yang, Xing-Sheng ; Shi, Ben-Kang
• Identification of Structurally Diverse Antimicrobials Through Sequential Application of Pharmacophore Modeling, Virtual Screening, Molecular Docking and In Vitro Microbiological Assay
  Mishra, Ruchi ; Paliwal, Sarvesh ; Agarwal, Ankita ; Sharma, Swapnil
• Docking Evaluation of the Interaction Between Green Tea Active Ingredient, l-Theanine and Human Serum Albumin
  Roslan, Amira Adlin ; Mohamad, Saharuddin B. ; Tayyab, Saad
• Unveiling the N-Terminal Homodimerization of BCL11B by Hybrid Solvent Replica-Exchange Simulations
  Schulig, Lukas ; Grabarczyk, Piotr ; Geist, Norman ; Delin, Martin ; Forkel, Hannes ; Kulke, Martin ; Delcea, Mihaela ; Schmidt, Christian A. ; Link, Andreas 2021 Universität Greifswald
• Polymorphism and Building‐Block‐Resolved STM Imaging of Self‐Assembled Monolayers of 4‐Fluorobenzenemethanethiol on Au (111)
  Azzam, Waleed ; Subaihi, Abdu ; Rohwerder, Michael ; Zharnikov, Michael ; Bashir, Asif
• Multiple automatic base selection: Protein–ligand docking based on incremental construction without manual intervention
  Rarey, Matthias ; Kramer, Bernd ; Lengauer, Thomas
• Quinolyl‐Based PGM Metallarectangles: Antiproliferative Activity, DNA and BSA Protein Interactions, and a Molecular Docking Perspective
  Golding, Taryn M. ; Omondi, Reinner O. ; Biswas, Supratim ; Chakraborty, Suparna ; Prince, Sharon ; Smith, Gregory S.
• Funktion und Regulation der Peroxine Pex14p und Pex17p in der peroxisomalen Biogenese der Hefe Saccharomyces cerevisiae
  Chan, Anna ; Erdmann, Ralf ; Schünemann, Danja 2017 Ruhr-Universität Bochum
• Combined Simulation and Mutation Studies to Elucidate Selectivity of Unsubstituted Amphetamine‐like Cathinones at the Dopamine Transporter
  Seddik, Amir ; Geerke, Daan P. ; Stockner, Thomas ; Holy, Marion ; Kudlacek, Oliver ; Cozzi, Nicholas V. ; Ruoho, Arnold E. ; Sitte, Harald H. ; Ecker, Gerhard F.
• Apoptosis‐Inducing Fe 2+/β ‐Cyclodextrin Supramolecular Nano–Particulate Complex as an Anticancer Drug Platform and Cancer‐Diagnostic Tool Prototype
  Sheta, Sheta M. ; El‐Sheikh, Said M. ; Abo‐Elfadl, Mahmoud T. ; Younis, Ahmed ; Abd‐Elzaher, Mohkles M. ; Othman, Hanibal ; Strothmann, Till ; Fetzer, Marcus N. A. ; Boldog, Istvan ; Janiak, Christoph
• Localization of the yeast RNA polymerase I‐specific subunits
  Bischler, Nicolas ; Brino, Laurent ; Carles, Christophe ; Riva, Michel ; Tschochner, Herbert ; Mallouh, Véronique ; Schultz, Patrick
• A biased random key genetic algorithm for the protein–ligand docking problem
  Leonhart, Pablo Felipe ; Spieler, Eduardo ; Ligabue-Braun, Rodrigo ; Dorn, Marcio
• Antioxidant Activity, Molecular Docking and Quantum Studies of New Bis ‐Schiff Bases Based on Benzyl Phenyl Ketone Moiety
  Jālandharī, Rašīd Aḥmad ; Alam, Aftab ; Khan, Momin ; Ali, Tahseen ; Elhenawy, Ahmed A. ; Ahmad, Manzoor
• Synthesis and Inhibitory Activity towards Monoamine Oxidase A and B of 8‐Functionalized 3‐Fluoro‐2‐methyl‐benzo (4,5) thiazolo (3,2‐ a) pyrimidin‐4‐ones
  Jafari, Behzad ; Jalil, Saquib ; Zaib, Sumera ; Safarov, Sayfidin ; Khalikova, Muattar ; Ospanov, Meirambek ; Yelibayeva, Nazym ; Abilov, Zharylkasyn A. ; Turmukhanova, Mirgul Z. ; Kalugin, Sergey N. ; Ehlers, Peter ; Iqbal, Jamshed ; Langer, Peter
• Interaction between shrimp and white spot syndrome virus through PmRab7-VP28 complex: an insight using simulation and docking studies
  Verma, Arunima Kumar ; Gupta, Shipra ; Verma, Sharad ; Mishra, Abha ; Nagpure, N. S. ; Singh, Shivesh Pratap ; Pathak, Ajey Kumar ; Sarkar, Uttam Kumar ; Singh, Shri Prakash ; Singh, Mahender ; Seth, Prahlad Kishore
• Orbiting on the Edge of Tomorrow: Inside the Lives of the ISS Trailblazers – A Technical Look at Daily Operations, Science, and Survival in Microgravity
  Harrington, Mia 2025 epubli
• Triple Inhibition of SARS‐CoV‐2 by Rhenium (I) Acetylacetonato Tricarbonyl Phosphine Complexes: Structural Features, DFT Calculations, HS Analysis and In Silico Molecular Docking Study
  Manicum, Amanda‐Lee E. ; Direm, Amani ; Athmani, Hamza ; Hakkar, Farida ; Parlak, Cemal ; Visser, Hendrik G. ; Schutte‐Smith, Marietjie ; Ramasami, Ponnadurai
• Synthesis, Spectroscopic Characterization, Antibacterial Activity, Reactivity Parameters, and Molecular Docking Studies of Some Pyridazine Derivatives
  Daoui, Said ; Parlak, Cemal ; Direkel, Şahin ; Ramasami, Ponnadurai ; Abuelizz, Hatem A. ; Oulmidi, Afaf ; Benchat, Noureddine ; Karrouchi, Khalid
• Small‐Molecule Allosteric Inhibitors of Human Aspartate Transcarbamoylase Suppress Proliferation of Bone Osteosarcoma Epithelial Cells
  Wang, Chao ; Zhang, Bidong ; Cong, Yingying ; Du, Xiaochen ; Chen, Siyao ; Visser, Lidia ; Ruiz‐Moreno, Angel J. ; Zhang, Lili ; Reggiori, Fulvio ; Dömling, Alexander ; Groves, Matthew R.
• Identification of alpha‐Synuclein Disaggregator from Camellia sp. Insight of Molecular Docking and Molecular Dynamics Simulations
  Vats, Sheetal ; Kondabala, Rajesh ; Saxena, Sanjai