#moleculardocking — Public Fediverse posts
Live and recent posts from across the Fediverse tagged #moleculardocking, aggregated by home.social.
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🧫 What secret molecular choreograph helps bacteria stay resilient against antibiotics and detergents?
🔗 Coordinated subdomain movements of MlaC regulate ligand binding and transport. Computational and Structural Biotechnology Journal, DOI: https://doi.org/10.1016/j.csbj.2025.05.031
📚 CSBJ: https://www.csbj.org/
#Microbiology #AntibioticResistance #MembraneBiology #StructuralBiology #ComputationalChemistry #MolecularDynamics #ComputationalBiology #Biophysics #ProteinStructure #DrugDiscovery #MolecularDocking
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🧫 What secret molecular choreograph helps bacteria stay resilient against antibiotics and detergents?
🔗 Coordinated subdomain movements of MlaC regulate ligand binding and transport. Computational and Structural Biotechnology Journal, DOI: https://doi.org/10.1016/j.csbj.2025.05.031
📚 CSBJ: https://www.csbj.org/
#Microbiology #AntibioticResistance #MembraneBiology #StructuralBiology #ComputationalChemistry #MolecularDynamics #ComputationalBiology #Biophysics #ProteinStructure #DrugDiscovery #MolecularDocking
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🧫 What secret molecular choreograph helps bacteria stay resilient against antibiotics and detergents?
🔗 Coordinated subdomain movements of MlaC regulate ligand binding and transport. Computational and Structural Biotechnology Journal, DOI: https://doi.org/10.1016/j.csbj.2025.05.031
📚 CSBJ: https://www.csbj.org/
#Microbiology #AntibioticResistance #MembraneBiology #StructuralBiology #ComputationalChemistry #MolecularDynamics #ComputationalBiology #Biophysics #ProteinStructure #DrugDiscovery #MolecularDocking
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🧫 What secret molecular choreograph helps bacteria stay resilient against antibiotics and detergents?
🔗 Coordinated subdomain movements of MlaC regulate ligand binding and transport. Computational and Structural Biotechnology Journal, DOI: https://doi.org/10.1016/j.csbj.2025.05.031
📚 CSBJ: https://www.csbj.org/
#Microbiology #AntibioticResistance #MembraneBiology #StructuralBiology #ComputationalChemistry #MolecularDynamics #ComputationalBiology #Biophysics #ProteinStructure #DrugDiscovery #MolecularDocking
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#BOINC Central is an open platform for scientists.
I’ve decided to start creating tutorials and publishing them on #Medium.
The first tutorial, covering #Autodock, #Vina, and #Vinardo, is available: https://medium.com/@lestat.de.lionkur/molecular-docking-with-autodock4-vina-and-vinardo-on-boinc-central-7117645d0551 -
#BOINC Central is an open platform for scientists.
I’ve decided to start creating tutorials and publishing them on #Medium.
The first tutorial, covering #Autodock, #Vina, and #Vinardo, is available: https://medium.com/@lestat.de.lionkur/molecular-docking-with-autodock4-vina-and-vinardo-on-boinc-central-7117645d0551 -
#BOINC Central is an open platform for scientists.
I’ve decided to start creating tutorials and publishing them on #Medium.
The first tutorial, covering #Autodock, #Vina, and #Vinardo, is available: https://medium.com/@lestat.de.lionkur/molecular-docking-with-autodock4-vina-and-vinardo-on-boinc-central-7117645d0551 -
#BOINC Central is an open platform for scientists.
I’ve decided to start creating tutorials and publishing them on #Medium.
The first tutorial, covering #Autodock, #Vina, and #Vinardo, is available: https://medium.com/@lestat.de.lionkur/molecular-docking-with-autodock4-vina-and-vinardo-on-boinc-central-7117645d0551 -
🦟 Could smarter protein modeling unlock eco-friendly pest control?
🔗 TBM preferred to AlphaFold 3 for functional models of insect odorant receptors. Computational and Structural Biotechnology Journal, DOI: https://doi.org/10.1016/j.csbj.2025.08.028
📚 CSBJ: https://www.csbj.org/
#ComputationalBiology #StructuralBiology #Bioinformatics #ProteinModeling #AlphaFold #MolecularDocking #DrugDiscovery #InsectScience #AIinBiology #TransmembraneProteins
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Identification of potential drug targets for achalasia from genetic insights: a Mendelian randomization study | Journal of Cardiothoracic Surgery
Acquisition of data and identification of instrumental variables To identify common single nucleotide polymorphisms (S…
#NewsBeep #News #US #USA #UnitedStates #UnitedStatesOfAmerica #Genetics #Achalasia #CardiacSurgery #Drugtargets #Expressionquantitativetraitloci #Mendelian #Moleculardocking #Science #ThoracicSurgery
https://www.newsbeep.com/us/8680/ -
Identification of potential drug targets for achalasia from genetic insights: a Mendelian randomization study | Journal of Cardiothoracic Surgery
Acquisition of data and identification of instrumental variables To identify common single nucleotide polymorphisms (S…
#NewsBeep #News #US #USA #UnitedStates #UnitedStatesOfAmerica #Genetics #Achalasia #CardiacSurgery #Drugtargets #Expressionquantitativetraitloci #Mendelian #Moleculardocking #Science #ThoracicSurgery
https://www.newsbeep.com/us/8680/ -
Identification of potential drug targets for achalasia from genetic insights: a Mendelian randomization study | Journal of Cardiothoracic Surgery
Acquisition of data and identification of instrumental variables To identify common single nucleotide polymorphisms (S…
#NewsBeep #News #US #USA #UnitedStates #UnitedStatesOfAmerica #Genetics #Achalasia #CardiacSurgery #Drugtargets #Expressionquantitativetraitloci #Mendelian #Moleculardocking #Science #ThoracicSurgery
https://www.newsbeep.com/us/8680/ -
https://www.europesays.com/uk/263730/ Identification of potential drug targets for achalasia from genetic insights: a Mendelian randomization study | Journal of Cardiothoracic Surgery #Achalasia #CardiacSurgery #DrugTargets #ExpressionQuantitativeTraitLoci #Genetics #Mendelian #MolecularDocking #Science #ThoracicSurgery #UK #UnitedKingdom
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🔬 Can AI help decode how antibodies recognize cancer-related proteins like HER2?
🔗 Investigating and evaluating potential antigen binding sites for monoclonal anti-HER2 antibodies: The LightDock approach. Computational and Structural Biotechnology Journal, DOI: https://doi.org/10.1016/j.csbj.2025.06.001
📚 CSBJ: https://www.csbj.org/
#HER2 #CancerResearch #MonoclonalAntibodies #LightDock #AlphaFold #Bioinformatics #MolecularDocking #InSilicoBiology #ComputationalBiology #AntibodyResearch #StructuralBiology
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Are you an academic researcher running #MolecularDocking?
Leverage #BOINC Central to access free, large-scale distributed computing for your #AutoDock #Vina jobs.
Our guide walks you through setup to submission:
https://github.com/BOINC/boinc-autodock-vina/wiki#Autodock:
https://youtu.be/NJ8sxnipMUs#Vina:
https://youtu.be/ypBh-Sw_jTg#Vinardo:
https://youtu.be/dGiZbEje-Ok -
Are you an academic researcher running #MolecularDocking?
Leverage #BOINC Central to access free, large-scale distributed computing for your #AutoDock #Vina jobs.
Our guide walks you through setup to submission:
https://github.com/BOINC/boinc-autodock-vina/wiki#Autodock:
https://youtu.be/NJ8sxnipMUs#Vina:
https://youtu.be/ypBh-Sw_jTg#Vinardo:
https://youtu.be/dGiZbEje-Ok -
Are you an academic researcher running #MolecularDocking?
Leverage #BOINC Central to access free, large-scale distributed computing for your #AutoDock #Vina jobs.
Our guide walks you through setup to submission:
https://github.com/BOINC/boinc-autodock-vina/wiki#Autodock:
https://youtu.be/NJ8sxnipMUs#Vina:
https://youtu.be/ypBh-Sw_jTg#Vinardo:
https://youtu.be/dGiZbEje-Ok -
Are you an academic researcher running #MolecularDocking?
Leverage #BOINC Central to access free, large-scale distributed computing for your #AutoDock #Vina jobs.
Our guide walks you through setup to submission:
https://github.com/BOINC/boinc-autodock-vina/wiki#Autodock:
https://youtu.be/NJ8sxnipMUs#Vina:
https://youtu.be/ypBh-Sw_jTg#Vinardo:
https://youtu.be/dGiZbEje-Ok -
Are you an academic researcher running #MolecularDocking?
Leverage #BOINC Central to access free, large-scale distributed computing for your #AutoDock #Vina jobs.
Our guide walks you through setup to submission:
https://github.com/BOINC/boinc-autodock-vina/wiki#Autodock:
https://youtu.be/NJ8sxnipMUs#Vina:
https://youtu.be/ypBh-Sw_jTg#Vinardo:
https://youtu.be/dGiZbEje-Ok -
New Title Alert: Uni-Dock has been added to the SBGrid software collection in the month of October. Uni-Dock is a GPU-accelerated molecular docking program developed by DP Technology. It supports various scoring functions including vina, vinardo, and ad4.
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New Title Alert: Uni-Dock has been added to the SBGrid software collection in the month of October. Uni-Dock is a GPU-accelerated molecular docking program developed by DP Technology. It supports various scoring functions including vina, vinardo, and ad4.
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New Title Alert: Uni-Dock has been added to the SBGrid software collection in the month of October. Uni-Dock is a GPU-accelerated molecular docking program developed by DP Technology. It supports various scoring functions including vina, vinardo, and ad4.
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Where does a guest molecule go inside a #MOF? Our multilevel approach #moleculardocking + #DFT will tell you! Check out Michelle’s latest work in JPhysChem C #compchem https://pubs.acs.org/doi/10.1021/acs.jpcc.2c05561
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Where does a guest molecule go inside a #MOF? Our multilevel approach #moleculardocking + #DFT will tell you! Check out Michelle’s latest work in JPhysChem C #compchem https://pubs.acs.org/doi/10.1021/acs.jpcc.2c05561
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Where does a guest molecule go inside a #MOF? Our multilevel approach #moleculardocking + #DFT will tell you! Check out Michelle’s latest work in JPhysChem C #compchem https://pubs.acs.org/doi/10.1021/acs.jpcc.2c05561
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Where does a guest molecule go inside a #MOF? Our multilevel approach #moleculardocking + #DFT will tell you! Check out Michelle’s latest work in JPhysChem C #compchem https://pubs.acs.org/doi/10.1021/acs.jpcc.2c05561
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Where does a guest molecule go inside a #MOF? Our multilevel approach #moleculardocking + #DFT will tell you! Check out Michelle’s latest work in JPhysChem C #compchem https://pubs.acs.org/doi/10.1021/acs.jpcc.2c05561