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46 ta ish

Ish: On the Automatic Optimization of Lipid Models in the Martini Force Field using SwarmCG

  1. Molecular dynamics trajectories for 630 coarse-grained drug-membrane permeations

    Christian Hoffmann, Alessia Centi, Roberto Menichetti +1

    Maqola20202 iqtibos
    ABI

  2. The structures of polyunsaturated lipid bilayers by joint refinement of neutron and X-ray scattering data

    Drew Marquardt, Frederick A. Heberle, Jianjun Pan +5

    Maqola20202 iqtibos
    ABI

  3. Designer protein assemblies with tunable phase diagrams in living cells

    Meta Heidenreich, Joseph M. Georgeson, Emanuele Locatelli +8

    Preprint20202 iqtibos
    ABI

  4. Protein–ligand binding with the coarse-grained Martini model

    Paulo C. T. Souza, Sebastian Thallmair, Paolo Conflitti +5

    Maqola20202 iqtibos
    ABI

  5. Evaluating Coarse-Grained MARTINI Force-Fields for Capturing the Ripple Phase of Lipid Membranes

    Pradyumn Sharma, Rajat Desikan, K. G. Ayappa

    Preprint20202 iqtibos
    ABI

  6. Coarse-Grained Force Fields from the Perspective of Statistical Mechanics: Better Understanding of the Origins of a MARTINI Hangover

    Zack Jarin, James S. Newhouse, Gregory A. Voth

    Maqola20212 iqtibos
    ABI

  7. Martini 3: a general purpose force field for coarse-grained molecular dynamics

    Paulo C. T. Souza, Riccardo Alessandri, Jonathan Barnoud +23

    Maqola20212 iqtibos
    ABI

  8. Martini 3 Coarse-Grained Force Field: Small Molecules

    Riccardo Alessandri, Jonathan Barnoud, Anders S. Gertsen +4

    Preprint20212 iqtibos
    ABI

  9. Martini 3 Coarse-Grained Model for Type III Deep Eutectic Solvents: Thermodynamic, Structural, and Extraction Properties

    Petteri A. Vainikka, Sebastian Thallmair, Paulo C. T. Souza +1

    Maqola20212 iqtibos
    ABI

  10. Martini 3 Coarse‐Grained Force Field: Small Molecules

    Riccardo Alessandri, Jonathan Barnoud, Anders S. Gertsen +4

    Maqola20212 iqtibos
    ABI

  11. Detecting dynamic domains and local fluctuations in complex molecular systems via timelapse neighbors shuffling

    Martina Crippa, Annalisa Cardellini, Cristina Caruso +1

    Preprint20222 iqtibos
    ABI

  12. Molecular dynamics simulation of an entire cell

    Jan A. Stevens, Fabian Grünewald, P. A. Marco van Tilburg +6

    Maqola20232 iqtibos
    ABI

  13. Molecular architecture and dynamics of SARS-CoV-2 envelope by integrative modeling

    Weria Pezeshkian, Fabian Grünewald, Oleksandr Narykov +6

    Maqola20232 iqtibos
    ABI

  14. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

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    Boshqa2 iqtibos
    ABI

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    Boshqa2 iqtibos
    ABI

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    Boshqa2 iqtibos
    ABI

  18. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

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    Boshqa1 iqtibos
    ABI

  20. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  21. Sarlavhasiz

    Boshqa1 iqtibos
    ABI