Fused Thiazolo[2,3‐b]Quinazolinone–Chromone Hybrids: Synthesis, Characterization, In Vitro Antibacterial Activity and In Silico Screening
Antimicrobial resistance is one of the biggest threats to public health across the globe.
Bacteria, fungi, viruses, and protozoans have been exhibiting resistance against …
Bacteria, fungi, viruses, and protozoans have been exhibiting resistance against …
Deciphering the 4′,7‐Dihydroxy‐3′‐Methylflavone from Boerhavia, Agonist/Antagonist Interactions Against 5‐HT2 Receptors using Homology Modeling …
P Salaria, DG Niharika, SRN N… - Chemistry & …, 2024 - Wiley Online Library
Seizures, depression, and anxiety are neurological disorders that affected innumerable
people worldwide. Recent research has revealed that targeting 5‐hydroxytryptamine 2 (5 …
people worldwide. Recent research has revealed that targeting 5‐hydroxytryptamine 2 (5 …
Exploring the Novel Anticonvulsant Phytochemicals from Glycyrrhiza glabra: An In Silico Approach
Computational methods like molecular docking, pharmacokinetic study, molecular dynamic
(MD) simulation and Molecular Mechanics‐Poisson‐Boltzmann Surface Area (MM‐PBSA) …
(MD) simulation and Molecular Mechanics‐Poisson‐Boltzmann Surface Area (MM‐PBSA) …
In silico investigation of potential phytoconstituents against ligand-and voltage-gated ion channels as antiepileptic agents
P Salaria, NN Subrahmanyeswara Rao, TM Dhameliya… - 3 Biotech, 2024 - Springer
The most promising anticonvulsant phytocompounds were explored in this work using
docking, molecular dynamic (MD) simulation, and Molecular Mechanics-Poisson–Boltzmann …
docking, molecular dynamic (MD) simulation, and Molecular Mechanics-Poisson–Boltzmann …
Investigation of Hydantoin‐Based Drugs Used in the Treatment of Epilepsy Using Quantum Chemical Calculations, Molecular Docking, Molecular Dynamics, ADMET …
MC Kandemir, B Bicak… - … Journal of Quantum …, 2024 - Wiley Online Library
Present investigation deals with the structural and pharmacokinetic properties of hydantoin‐
based drug molecules such as phenytoin, mephenytoin, and ethotoin. Hydantoin‐based …
based drug molecules such as phenytoin, mephenytoin, and ethotoin. Hydantoin‐based …
Design, synthesis and biological evaluation of indazole carboxamide analogues as potential anticancer agents
JR Alla, SK Badampudi, DG Niharika, A Reddy… - Journal of Molecular …, 2025 - Elsevier
Novel indazole carboxamides (3a-j) were synthesized using conventional, catalytic, and
green methods. Their anti-proliferative activities were evaluated through in vitro and in silico …
green methods. Their anti-proliferative activities were evaluated through in vitro and in silico …
Computational Profile of Novel Natural Bioactive Inhibitors of NF-κB: Computational Profile of Novel Natural Bioactive Inhibitors
Nuclear factor-κB (NF-κB) represents a family of inducible transcription factors, which
regulates a large array of genes involved in different processes of the immune and …
regulates a large array of genes involved in different processes of the immune and …