51 research outputs found
PASS pharmacological activity prediction of experimental compounds.
PASS pharmacological activity prediction of experimental compounds.</p
GC-MS study of phytochemical components in methanol extract of green jackfruit flour.
(DOCX)</p
Virtual screening results selected phytocompounds of JME docked with the human MAPK3.
Virtual screening results selected phytocompounds of JME docked with the human MAPK3.</p
Pharmacokinetic mapping of experimental compounds.
A) caffeic acid, B) DBDEA, C) syringic acid, and D) metformin.</p
Graphical representation of binding free energies of protein-ligand complexes.
Graphical representation of binding free energies of protein-ligand complexes.</p
Screening of active compounds using ADMET criteria.
Screening of active compounds using ADMET criteria.</p
Fig 9 -
Arrangement (A2) and binding pattern (B2) of binding interactions of DBDEA from JME with the residues of human MAPK3 protein.</p
Binding free energy values of JME phytocompounds and metformin complexed with human MAPK3 protein.
Binding free energy values of JME phytocompounds and metformin complexed with human MAPK3 protein.</p
Fig 11 -
Arrangement (A4) and binding pattern (B4) of binding interactions of metformin from JME with the residues of human MAPK3 protein.</p
Binding interactions of compound 6b and acarbose with α-glucosidase along with their bond length (Å).
Binding interactions of compound 6b and acarbose with α-glucosidase along with their bond length (Å).</p
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