Articles with "parameter sets" as a keyword



MODELING OF LAMPREY RETICULOSPINAL NEURONS: MULTIPLE DISTINCT PARAMETER SETS YIELD REALISTIC SIMULATIONS.

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Published in 2020 at "Journal of neurophysiology"

DOI: 10.1152/jn.00070.2020

Abstract: For the lamprey and other vertebrates, reticulospinal (RS) neurons project descending axons to the spinal cord and activate motor networks to initiate locomotion and other behaviors. In the present study, a biophysically-detailed computer model of… read more here.

Keywords: lamprey reticulospinal; parameter sets; reticulospinal neurons; modeling lamprey ... See more keywords

Assessing the effect of forcefield parameter sets on the accuracy of relative binding free energy calculations

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Published in 2022 at "Frontiers in Molecular Biosciences"

DOI: 10.3389/fmolb.2022.972162

Abstract: Software for accurate prediction of protein-ligand binding affinity can be a key enabling tool for small molecule drug discovery. Free energy perturbation (FEP) is a computational technique that can be used to compute binding affinity… read more here.

Keywords: assessing effect; energy; free energy; effect forcefield ... See more keywords

Empirical and Computational Evaluation of Hemolysis in a Microfluidic Extracorporeal Membrane Oxygenator Prototype

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Published in 2024 at "Micromachines"

DOI: 10.3390/mi15060790

Abstract: Microfluidic devices promise to overcome the limitations of conventional hemodialysis and oxygenation technologies by incorporating novel membranes with ultra-high permeability into portable devices with low blood volume. However, the characteristically small dimensions of these devices… read more here.

Keywords: hemolysis; parameter sets; microfluidic devices; blood ... See more keywords