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Journal of Biomolecular Structure & Dynamics|October 31, 2023
A comprehension on structure guided alignment dependent 3D-QSAR modelling, and molecular dynamics simulation on 2,4-thiazolidinediones as aldose reductase inhibitors for the management of diabetic complicationsPriyadarshi Gautam, Priya Bisht, Anupam Gautam, et al.Journal of Biomolecular Structure & Dynamics|November 1, 2023
Study of self-assembling properties of HBc-VLP derivatives aided by molecular dynamic simulations from a thermodynamic perspectiveHong Luo, Yanyan Ma, Ying Ren, et al.Journal of Biomolecular Structure & Dynamics|October 31, 2023
In silico approaches for the identification of novel ULK1 inhibitors: pharmacophore model, molecular docking and molecular dynamics simulationsYifan Yang, Cuicui Ji, Qidi Zhong, et al.Journal of Biomolecular Structure & Dynamics|October 28, 2023
Predictive ability of physiochemical properties of benzene derivatives using Ve-degree of end vertices-based entropyMuhammad Naeem, Abdul Rauf, Muhammad Waleed Mumtaz, et al.Journal of Biomolecular Structure & Dynamics|October 27, 2023
Rational design of hybrid peptide with high antimicrobial property derived from Melittin and LasioglossinSomayeh Nabizadeh, Leila Rahbarnia, Jamileh Nowrozi, et al.Journal of Biomolecular Structure & Dynamics|October 26, 2023
Development of multi-epitope based subunit vaccine against Mycobacterium Tuberculosis using immunoinformatics approachSavita Kumari R, Guneswar Sethi, Ramadas KrishnaJournal of Biomolecular Structure & Dynamics|October 26, 2023
The multi-protein targeting potential of bioactive syringin in inflammatory diseases: using molecular modelling and in-silico analysis of regulatory elementsVipendra Kumar Singh, D C Thakur, Naina Rajak, et al.Journal of Biomolecular Structure & Dynamics|October 20, 2023
Networkodynamic approach to perceive the key phytoconstituents of E. officinalis (Amla) as natural BACE1 inhibitors: an in-silico studyDhairiya Agarwal, Jatin Malik, Neeru Bhanwala, et al.Journal of Biomolecular Structure & Dynamics|October 19, 2023
Inquest for the interaction of canonical and non-canonical DNA/RNA bases with ternary based 2D Si2BN and doped Si2BN for biosensing applicationsAkilesh Muralidharan, Mohanapriya Subramani, Divyakaaviri Subramani, et al.Journal of Biomolecular Structure & Dynamics|March 27, 2024
In silico validation of hyaluronic acid - drug conjugates based targeted drug delivery for the treatment of COVID-19Mohan Mani, Mahesh Vellusamy, Thirumalaisamy Rathinavel, et al.Pageof 935