Asosiy kontentga oʻtish
AkademIndex

Xizmatlar

← Ishga qaytish

Ushbu ish iqtibos qilgan ishlar

55 ta ish

Ish: An exploration of the binding prediction of anatoxin-a and atropine to acetylcholinesterase enzyme using multi-level computer simulations

  1. VMD: Visual molecular dynamics

    William Humphrey, Andrew Dalke, Klaus Schulten

    Maqola199691 iqtibos
    ABI

  2. THE weighted histogram analysis method for free‐energy calculations on biomolecules. I. The method

    Shankar Kumar, John M. Rosenberg, Djamal Bouzida +2

    Maqola199212 iqtibos
    ABI

  3. Oxidation of Innate Immune Checkpoint CD47 on Cancer Cells with Non-Thermal Plasma

    Abraham Lin, Jamoliddin Razzokov, Hanne Verswyvel +7

    MaqolaOchiq kirishPlasma Applications and DiagnosticsCancers202110 iqtibos
    ABI

  4. Structure and Dynamics of the TIP3P, SPC, and SPC/E Water Models at 298 K

    Pekka Mark, Lennart Nilsson

    Maqola20019 iqtibos
    ABI

  5. CHARMM‐GUI: A web‐based graphical user interface for CHARMM

    Sunhwan Jo, Taehoon Kim, Vidyashankara Iyer +1

    Maqola20087 iqtibos
    ABI

  6. LINCS: A linear constraint solver for molecular simulations

    Berk Hess, Henk Bekker, Herman J. C. Berendsen +1

    Maqola19975 iqtibos
    ABI

  7. CHARMM: The biomolecular simulation program

    Bernard R. Brooks, Charles L. Brooks, Alexander D. MacKerell +32

    Sharh maqola20095 iqtibos
    ABI

  8. Transport of cystine across<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si1.gif" overflow="scroll"><mml:mrow><mml:mi mathvariant="bold">x</mml:mi><mml:msup><mml:mrow><mml:mi mathvariant="bold">C</mml:mi></mml:mrow><mml:mrow><mml:mo>−</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:math>antiporter

    Maryam Ghasemitarei, Maksudbek Yusupov, Jamoliddin Razzokov +2

    Maqola20194 iqtibos
    ABI

  9. <i>g_mmpbsa</i>—A GROMACS Tool for High-Throughput MM-PBSA Calculations

    Rashmi Kumari, Rajendra Kumar, Open Source Drug Discovery Consortium +1

    Maqola20144 iqtibos
    ABI

  10. Bias-force guided simulations combined with experimental validations towards GPR17 modulators identification

    Sana Kari, Akshaya Murugesan, Ramesh Thiyagarajan +5

    MaqolaOchiq kirishReceptor Mechanisms and SignalingBiomedicine & Pharmacotherapy20233 iqtibos
    ABI

  11. ACPYPE - AnteChamber PYthon Parser interfacE

    Alan Sousa da Silva, Wim Vranken

    Maqola20123 iqtibos
    ABI

  12. Improved side‐chain torsion potentials for the Amber ff99SB protein force field

    Kresten Lindorff‐Larsen, Stefano Piana, Kim Palmö +4

    Maqola20103 iqtibos
    ABI

  13. Automatic atom type and bond type perception in molecular mechanical calculations

    Junmei Wang, Wei Wang, Peter A. Kollman +1

    Maqola20062 iqtibos
    ABI

  14. Acetylcholinesterase inhibitors from plants

    Pulok K. Mukherjee, Venkatesan Kumar, Mainak Mal +1

    Sharh maqola20072 iqtibos
    ABI

  15. MMFF VI. MMFF94s option for energy minimization studies

    Thomas A. Halgren

    Maqola19992 iqtibos
    ABI

  16. From Proteins to Perturbed Hamiltonians: A Suite of Tutorials for the GROMACS-2018 Molecular Simulation Package [Article v1.0]

    Justin A. Lemkul

    Maqola20182 iqtibos
    ABI

  17. PrankWeb: a web server for ligand binding site prediction and visualization

    Lukáš Jendele, Radoslav Krivák, Petr Škoda +2

    Maqola20192 iqtibos
    ABI

  18. In Silico Analysis of Binding Stability of Quercetin with CmpA and In Vitro Growth Inhibition Study of Cyanobacterial Species Using Azadirachta indica Extracts

    Showkat Ahmad Mir, Binata Nayak

    Maqola20222 iqtibos
    ABI

  19. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  20. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  21. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  22. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  23. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  24. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  25. Sarlavhasiz

    Boshqa1 iqtibos
    ABI