„docking“

Suchergebnisse

7.903 Treffer

• ProPose: a docking engine based on a fully configurable protein–ligand interaction model
  Seifert, Markus H. J. ; Schmitt, Frank ; Herz, Thomas ; Kramer, Bernd
• Comparison of two implementations of the incremental construction algorithm in flexible docking of thrombin inhibitors
  Knegtel, Ronald M.A ; Bayada, Denis M. ; Engh, Richard A. ; von der Saal, Wolfgang ; van Geerestein, Vincent J. ; Grootenhuis, Peter D.J
• On the molecular interaction between lactoferrin and the dye Red HE-3B. A novel approach for docking a charged and highly flexible molecule to protein surfaces
  Grasselli, Mariano ; Cascone, Osvaldo ; Anspach, F. Birger ; Delfino, Jose M.
• Indole hybridized diazenyl derivatives: synthesis, antimicrobial activity, cytotoxicity evaluation and docking studies
  Kaur, Harmeet ; Singh, Jasbir ; Narasimhan, Balasubramanian
• Docking, thermodynamics and molecular dynamics (MD) studies of a non-canonical protease inhibitor, MP-4, from Mucuna pruriens
  Kumar, Ashish ; Kaur, Harmeet ; Jain, Abha ; Nair, Deepak T. ; Salunke, Dinakar M.
• In silico Drug Design – Complete guide to Computational Drug Design
  Dhiman, Priyanka ; Malik, Neelam ; Khatkar, Anurag 2019 LAP LAMBERT Academic Publishing
• Structural Insight into Inhibition of CsrA-RNA Interaction Revealed by Docking, Molecular Dynamics and Free Energy Calculations
  Ren, Xiaodong ; Zeng, Rui ; Tortorella, Micky ; Wang, Jinming ; Wang, Changwei
• Docking Studies on the Complexed and Uncomplexed FKBP12 Structures with Bound and Unbound Ligands: An Implication of a Conformational Selection Mechanism for Binding
  Pang, Yuan-Ping ; Silva, Norberto D. ; Haydock, Christopher ; Prendergast, Franklyn G.
• Conjugate symbiotic populations part II: Analysis of nfr5 receptor gene polymorphisms using molecular docking
  Porozov, Yu. B. ; Muntyan, A. N. ; Chizhevskaya, E. P. ; Simarov, B. V. ; Andronov, E. E.
• A docking-based receptor library of antibiotics and its novel application in predicting chronic mixture toxicity for environmental risk assessment
  Zou, Xiaoming ; Zhou, Xianghong ; Lin, Zhifen ; Deng, Ziqing ; Yin, Daqiang
• cis-nitenpyram analogues bearing acyloxy segments anchored on the tetrahydropyrimidine ring: Synthesis, insecticidal activities and molecular docking studies
  Sun, Chuan-wen ; Wu, Ying ; Chen, Yan-xia ; Nan, Shi-bin ; Zhang, Wang-geng
• Synthesis, docking and anticancer activity studies of D-proline-incorporated wainunuamide
  HIMAJA, M. ; Ranjitha, A. ; Mali, Sunil V.
• Virtual fragment screening: an exploration of various docking and scoring protocols for fragments using Glide
  Kawatkar, Sameer ; Wang, Hongming ; Czerminski, Ryszard ; Joseph-McCarthy, Diane
• Structural Modeling of the NS 3 helicase of Tick-borne encephalitis virus and their virtual screening of potent drugs using molecular docking
  Singh, Vijai ; Somvanshi, Pallavi
• Influence of Silybum Marianum on Morphine Addicted Rats, Biochemical Parameters and Molecular Simulation Studies on µ-Opioid Receptor
  Malekshah, Rahime Eshaghi ; Khaleghian, Ali
• Molecular docking and simulation of Zika virus NS3 helicase
  Badshah, Syed Lal ; Ahmad, Nasir ; Rehman, Ashfaq Ur ; Khan, Khalid ; Ullah, Asad ; Alsayari, Abdulrhman ; Muhsinah, Abdullatif Bin ; N. Mabkhot, Yahia
• Applying flexible molecular docking to simulate protein retention behavior in hydrophobic interaction chromatography
  Zhou, Peng ; Tian, FeiFei ; Li, ZhiLiang
• Modeling and Docking of the Three-Dimensional Structure of the Human Melanocortin 4 Receptor
  Yang, Xiaonan ; Wang, Zhuorui ; Dong, Wei ; Ling, Lunjiang ; Yang, Huanming ; Chen, Runsheng
• Chemical inhibition of fatty acid synthase: molecular docking analysis and biochemical validation in ocular cancer cells
  Deepa, P. R. ; Vandhana, S. ; Muthukumaran, S. ; Umashankar, V. ; Jayanthi, U. ; Krishnakumar, S.
• H-ROV-LARS: Entwicklung eines Aussetz- und Bergesystems mit integrierter, neuartiger Kommunikation und Ortung für das Hybrid-ROV (LARS), Schlussbericht.
  Meinecke, Gerrit 2019 MARUM - Zentrum für Marine Umweltwissenschaften der Universität Bremen