Md Fulbabu Sk

24PUBLICATIONS
13CO-AUTHORS
Signal transductionStructural biology (incl. macromolecular modelling)Cheminformatics and quantitative structure-activity relationshipsBiologically active moleculesMedical infection agents (incl. prions)
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Publications (24)

|Jun 30, 2025
Unlocking the Conformational Secrets of DYRK1A Kinase With Computational Microscope: Exploring Phosphorylation-Driven Structural Dynamics.

Kapil Dattatray Ursal, Md Fulbabu Sk, Subhasmita Mahapatra

|Oct 21, 2024
Dynamic Interplay of Loop Motions Governs the Molecular Level Regulatory Dynamics in Spleen Tyrosine Kinase: Insights from Molecular Dynamics Simulations.

Sunanda Samanta, Md Fulbabu Sk, Suman Koirala

|Feb 07, 2024
Deciphering the molecular choreography of Janus kinase 2 inhibition via Gaussian accelerated molecular dynamics simulations: a dynamic odyssey.

Md Fulbabu Sk, Sunanda Samanta, Sayan Poddar

|Oct 26, 2023
Exploring molecular interactions of potential inhibitors against the spleen tyrosine kinase implicated in autoimmune disorders via virtual screening and molecular dynamics simulations.

S Samanta, M F Sk, S Koirala

|Oct 03, 2023
Microsecond dynamics of H10N7 influenza neuraminidase reveals the plasticity of loop regions and drug resistance due to the R292K mutation.

Md Fulbabu Sk, Sunanda Samanta, Sayan Poddar

|Nov 18, 2022
Finding inhibitors and deciphering inhibitor-induced conformational plasticity in the Janus kinase via multiscale simulations.

M F Sk, P Kar

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Frequent Collaborators

24 joint publications

Parimal Kar

10 joint publications

Rajarshi Roy

10 joint publications

Nisha Amarnath Jonniya

4 joint publications

Sunanda Samanta