2024

60. Quantum chemical design of next-generation photoactive CO-Releasing Materials, Anik Sen* and Rahul Shukla* Computational and Theoretical Chemistry, 2024, 1244, 115009 DOI: https://doi.org/10.1016/j.comptc.2024.115009, I.F. = 2.9 , Q2

59. Unravelling the Mechanistic ‘Black Box’ of Heterogeneous Condensation Reactions Catalyzed by Aminosilicas, Parijat Borah* Preeti Nanda Sahu, Anik Sen* and Miquel A. Pericàs*, Journal of Catalysis, 440, 115852,  DOI:https://doi.org/10.1016/j.jcat.2024.115852  I.F.= 6.0, , Q1

58. Tuning Electronic Properties of Zirconia (ZrO2 ) Through Non-Metal Dopants: A Computational Investigation, Vipul Kumar Ambasta, Somnath Ghosh* and Anik Sen*, Accepted in Journal of Physics and Chemistry of Solids, 2024, 197, 112412, DOI: https://doi.org/10.1016/j.jpcs.2024.112412  I.F. = 5.9, , Q1

57. Phytochemical Analysis and Anti-inflammatory Potential of Floscopascandens Lour and Exploring Ecdysterone as Promising Therapeutic Agent: An HR-LCMS screening and Molecular Docking analysis, Sailaja Nambaaru, Preeti Nanda Sahu, Sunitha Katta,* Veera Raghava Sarma Ganapavarapu and Anik Sen*, Chemistry Select, 9, e202403146, DOI: https://doi.org/10.1002/slct.202403146 , I.F. = 2.3, , Q3

56. Optimal Donor Groups for Novel Organic Dye "3-(5-(4-(Diphenylamino)styryl)thiophen-2-yl)-2-cyanoacrylic Acid" in the Context of N‑Type Dye-Sensitized Solar Cells: A Theoretical Investigation, Preeti Nanda Sahu, Rajesh Kumar Kumili and Anik Sen* Computational and Theoretical Chemistry, 2024, 1241, 114901,  doi: https://doi.org/10.1016/j.comptc.2024.114901, I.F. = 2.9,, Q2

55. Advancements in Tartrazine Dye Removal Using Multiwalled Carbon Nanotubes: Integrating Materials Science, Computational Chemistry, and Data Science, Abhishek Dhar,* Anil Kumar Behera, Kaushik Gupta, Dipta Chatterjee, Nilavo Boral, Rohit L. Vekariya, Priyatosh Sarkar and Anik Sen*  Journal of Molecular Liquids, 2024, 414, 126043,  DOI: https://doi.org/10.1016/j.molliq.2024.126043 I.F. = 5.2, Q1

54.  Investigating the Multifunctionality of Fluorinated Donepezil Derivatives for Alzheimer's Disease, Sunandini Swain, Anik Sen*, Atanu K Metya*, Accepted  in Journal of Molecular Liquids, 2024, 409, 125500, DOI: https://doi.org/10.1016/j.molliq.2024.125500, I.F. = 5.2, Q1

53.   Computational Study on Metal-Free Dye-Sensitized Solar Cells Utilizing Heterocyclic Derivative π-Spacers with Open and Fused Rings: Design and Analysis of D-π-A-π-A Dye Sensitizers, Anil Kumar Behara and Anik Sen* 2024, Materials Today Communications 40, 109465 , DOI: https://doi.org/10.1016/j.mtcomm.2024.109465, I.F. = 4.9, Q1

52.   Donor effect on the B¬N dative bond directed Dye Sensitized Solar Cell application,Anil Kumar Behara, Preeti Nanda Sahu, Rahul Shukla* and Anik Sen* 2024, Computational and Theoretical Chemistry, 1236, 114606,  DOI: https://doi.org/10.1016/j.comptc.2024.114606, I.F. = 2.9, Q2

51.   Hydrogen and Halogen Bonding Directed Trimeric Supramolecular Motifs in Halogenated 1,2,4-Triazoles, Rahul Shukla* and  Anik  Sen* 2024, Acta Crystallographica Section B, 80, 163, DOI: https://doi.org/10.1107/S2052520624002427,  I.F. = 1.3, Q2

50.   Preventing Cancer by Inhibiting Ornithine Decarboxylase: A Comparative Perspective on Synthetic vs. Natural Drugs , Preeti Nanda Sahu and Anik Sen*  Chemistry and Biodiversity, 2024, 21, e202302067, I.F. = 2.9   DOI: https://doi.org/10.1002/cbdv.202302067, , Q3 

49.  Rational design for novel heterocyclic based Donepezil analogs for Alzheimer’s disease: an in silico approach, Sunandini Swain, Anik Sen*, Atanu K Metya*, Journal of Biomolecular Structure and Dynamics, 2024,, I.F. = 2.4   DOI: https://doi.org/10.1080/07391102.2024.2306200, Q2