S.No.	Authors	Title	Journal	Volume	Pages	Year
1	#Kalra, Vinni#Silakari, Om#Tiwary, Ashok Kumar	Veracity of In Silico Approach for Designing Rivastigmine-Polymer Nano Complexes for Intranasal Delivery: Prediction and In Vitro Validation	Journal of Pharmaceutical Innovation	19	82	2024
2	#Yadav, Manisha#Raju, Baddipadige#Narendra, Gera#Kaur, Jasveer#Kumar, Manoj#Silakari, Om#Sapra, Bharti	Leveraging machine learning to predict drug permeation: impact of menthol and limonene as enhancers	Molecular Diversity			2024
3	#Parveen, Shama#Bhattacharya, Arijit#Silakari, Om#Sapra, Bharti	First report on QSAR modelling for chemical penetration enhancement ratio (ER) of different FDA-approved drugs in Poloxamer 407: A next step towards better skin permeability of drugs	International Journal of Pharmaceutics	669	125083	2025
4	#Parveen ,Shama#, Kaur ,Jasveer#, Silakari ,Om# and Sapra ,Bharti	Optimizing voriconazole-loaded thermoresponsive hydrogel: in silico tools and ex vivo studies	Drug Development and Industrial Pharmacy	51	144	2025
5	#Kalra, Vinni#Silakari, Om#Tiwary, Ashok Kumar	Intranasal administration of in silico designed Rivastigmine mucoadhesive nanoparticles ameliorates scopolamine-induced Alzheimer’s symptoms in mice: Pharmacokinetic and pharmacodynamic evidences	International Journal of Pharmaceutics	677	125635	2025
6	#Bhandu, Priyanka#Verma, Himanshu#Raju, Baddipadige#Narendra, Gera#Choudhary, Shalki#Singh, Manmeet#Singh, Pankaj Kumar#Silakari, Om	Identification of natural peptides from PlantPepDB database as anti-SARS-CoV-2 agents: A protein-protein docking approach	Phytomedicine Plus	3	100446	2023
7	#Sharma, Himani#Raju, Baddipadige#Narendra, Gera#Kumar, Manoj#Verma, Himanshu#Sharma, Bhavna#Tung, Gurleen Kaur#Kumar Jain, Subheet#Brás, Natércia F.#Silakari, Om	In silico guided designing of optimized benzochalcones derivatives as potent CYP1B1 inhibitors: An integrated in vitro and ONIOM study	Journal of Molecular Graphics and Modelling	119	108390	2023
8	#Singh, Manmeet#Verma, Himanshu#Bhandu, Priyanka#Kumar, Manoj#Narendra, Gera#Choudhary, Shalki#Singh, Pankaj Kumar#Silakari, Om	Network Analysis Guided Designing of Multi-Targeted Anti-Fungal Agents: Synthesis and Biological Evaluation	Journal of Molecular Structure	1272	134128	2023
9	#Sharma, Himani#Raju, Baddipadige#Narendra, Gera#Motiwale, Mohit#Sharma, Bhavna#Verma, Himanshu#Silakari, Om	QM/MM Studies on Enzyme Catalysis and Insight into Designing of New Inhibitors by ONIOM Approach: Recent Update	ChemistrySelect	8	e202203319	2023
10	#Bhandu, Priyanka#Verma, Himanshu#Singh, Manmeet#Kumar, Manoj#Narendra, Gera#Choudhary, Shalki#Singh, Pankaj Kumar#Silakari, Om	Rational designing of quinazolin-4(3H)-one based ALR2 inhibitors: Synthesis and biological evaluation	Journal of Molecular Structure	1270	133825	2022
11	#Kumar, Manoj#Kumar Singh, Pankaj#Choudhary, Shalki#Silakari, Om	Hydantoin based dual inhibitors of ALR2 and PARP-1: Design, synthesis, in-vitro and in-vivo evaluation	Bioorganic Chemistry	129	106108	2022
12	#Sharma, Priyanka#Raju, Baddipadige#Narendra, Gera#Sapra, Bharti#Silakari, Om	Molecular Docking, Dynamics, and WaterSwap Analysis to Identify Anti-aggregating Agents of Insulin and IFN-β	Applied Biochemistry and Biotechnology	194	3261	2022