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International Journal of Molecular Sciences|January 25, 2012
3D-QSPR method of computational technique applied on red reactive dyes by using CoMFA strategyUzma Mahmood, Sitara Rashid, S Ishrat Ali, et al.
BMC Chemistry|July 23, 2025
A convergence of synthesis and antimicrobial research: imidazolium based dicationic ionic liquidsHira Akram, Bushra Arshad, Menahil Imtiaz, et al.
ACS Chemical Neuroscience|January 10, 2026
Santonin Attenuates Alzheimer's-Like Pathology via Multitarget Modulation of the NLRP3 Inflammasome, BDNF Signaling, and Amyloidogenic Pathways: An Integrated Experimental and Computational StudyMuhammad Noman, Halima Qadir, Sagheer Ahmed, et al.
Scientific Reports|December 2, 2020
Identification of potential TNF-α inhibitors: from in silico to in vitro studiesKomal Zia, Sajda Ashraf, Almas Jabeen, et al.
Archiv Der Pharmazie|June 17, 2024
Imidazole-thiadiazole hybrids: A multitarget de novo drug design approach, in vitro evaluation, ADME/T, and in silico studiesMaryam Maqbool, Mehwish Solangi, Khalid M Khan, et al.
BMC Chemistry|November 22, 2025
L-Glycine and L-leucine derived multifunctional ionic liquids for potential antibacterial applications: in-vitro and in-silico studiesAmina Arshad, Hira Akram, Habib Ullah, et al.
Scientific Reports|May 12, 2026
1,3,4 oxadiazole derivative attenuates neurotransmitter-mediated inflammatory response in EAE model of multiple sclerosisSyeda Rida Zainab, Jehan Zeb Khan, Humaira Nadeem, et al.
Proteins|September 17, 2025
In Silico Characterization of Bromo-DragonFLY Binding to the 5-HT2A Receptor: Molecular Insights Into a Potent Designer PsychedelicSyeda Sumayya Tariq, Urooj Qureshi, Mamona Mushtaq, et al.
Journal of Molecular Graphics & Modelling|February 27, 2025
Drug likeliness, pharmacokinetics profiling and efficacy of Polyscias fulva bioactive compounds in the management of uterine fibroids; An integrative in silico and in vivo approachKenedy Kiyimba, Lincoln Munyendo, Samuel Baker Obakiro, et al.
Future Medicinal Chemistry|November 12, 2024
Synthesis of arylated tetrahydrobenzo[H]quinoline-3-carbonitrile derivatives as potential hits for treatment of diabetesFaiza Seraj, Fouzia Naz, Musa Özil, et al.
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