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Publications by Simrika Thapa
Molecular Docking Simulations Provide Insights in the Substrate Binding Sites and Possible Substrates of the ABCC6 Transporter
PLoS ONE
Multidisciplinary
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Do the Binding Sites of Substrates and Tricyclic Antidepressants Overlap on the Serotonin Transporter?
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Docking Simulations of Perylene-Hsa Binding
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Molecular Docking to Explore the Possible Binding Mode of Potential Inhibitors of Thioredoxin Glutathione Reductase
Molecular Medicine Reports
Oncology
Genetics
Molecular Biology
Biochemistry
Cancer Research
Molecular Medicine
Selective Inhibition of IRE1 Signalling Mediated by MKC9989: New Insights From Molecular Docking and Molecular Dynamics Simulations
ChemistrySelect
Chemistry
Computational Investigation of Locked Nucleic Acid (LNA) Nucleotides in the Active Sites of DNA Polymerases by Molecular Docking Simulations
PLoS ONE
Multidisciplinary
Molecular Interactions Between Fenoterol Stereoisomers and Derivatives and the Β2-Adrenergic Receptor Binding Site Studied by Docking and Molecular Dynamics Simulations
Journal of Molecular Modeling
Organic Chemistry
Theoretical Chemistry
Inorganic Chemistry
Computer Science Applications
Mathematics
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Catalysis
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Roles of PIP2 in the Membrane Binding of MIM I-Bar: Insights From Molecular Dynamics Simulations
FEBS Letters
Genetics
Cell Biology
Molecular Biology
Biochemistry
Structural Biology
Biophysics
Mapping Cholesterol Binding Sites on the Human Dopamine Transporter
Biophysical Journal
Biophysics
Molecular Dynamics Simulations of Gp120 and Gp41 of HIV Env Provide Insights Into Strain Specificity and the Role of the Membrane Environment
Biophysical Journal
Biophysics