Amit Kumar Halder

Institute of Health Studies and Rehabilitation — India

Computer Science · Physical Sciences

22h-index1.5kcitations119works3.12yr avg
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Research Topics

Computational Drug Discovery Methods(59), Synthesis and biological activity(18), Ionic liquids properties and applications(7), Remote-Sensing Image Classification(5), Cholinesterase and Neurodegenerative Diseases(5)

Publications119 total

Mechanistic Mapping of Aquatic Toxicity of Per- and Poly-fluoroalkyl Substances: Machine Learning-Driven Approach for Environmental Risk Assessment of 'Forever-Chemicals'
SSRN Electronic Journal·2026Open Access
Toward Development of “FXR PREDICTOR”: A Web‐Based Application for Estimating Biological Activity of Chemical Compounds Toward Farnesoid X Receptor
ChemistrySelect·2026
Multi-scale in-silico modelling to unveil structural requirements for DNA-PK inhibitors as radiosensitizers and MolSHAP based design of novel ligands
Journal of Computer-Aided Molecular Design·2025
Role of nanomedicines in type 2 diabetes
Elsevier eBooks·2025
Nanotechnology for the therapeutic use of biologics to treat metabolic disorders
Elsevier eBooks·2025
List of contributors
Elsevier eBooks·2025Open Access
Nanomedicines to alleviate hepatic metabolic disorders
Elsevier eBooks·2025
Membrane-disrupting antibacterial activity of Artocarpus lacucha bark extract: a mechanistic study through experimental and computational approaches
Journal of Ethnopharmacology·2025Open Access
Prebiotics and Probiotics in Alzheimer’s Disease
Nutritional neurosciences·2025
Multi-scale in-silico modelling to unveil structural requirements for DNA-PK inhibitors as radiosensitizers and MolSHAP based design of novel ligands
2025Open Access
Targeting NAFLD and NASH with Tinospora crispa: insights from network pharmacology and molecular dynamics
Journal of Herbal Medicine·2025· 10 cited
Toxicological evaluation of Artocarpus lacucha ethyl acetate extract: in vitro and in vivo assessment
Journal of Ethnopharmacology·2025· 8 citedOpen Access
Structural insights into molecular and cellular level FXR binding potentials of GW4064 and LY2562175 hybrids by multi in silico modelling analyses
Journal of Molecular Modeling·2025· 4 cited
Machine Learning-Guided Prediction of Activation Energies for Catalyst Design in the Water Gas Shift Reaction
The Journal of Physical Chemistry C·2025· 6 cited
Predicting mito-target interactions for per-and poly-fluoroalkyl compounds: Mapping mitochondrial toxicity on zebrafish voltage-dependent anion channel 2
Aquatic Toxicology·2025· 3 citedOpen Access
Preclinical Evaluation of Thrombocytopenic Activity of Hydro-Alcoholic Extract of Psidium guajava L. Fruits on Wistar Rats with in silico Modelling on Dengue Virus Protease Inhibitors
Indian Journal of Pharmaceutical Education and Research·2025
Predicting the Aquatic Toxicity of Pharmaceutical and Personal Care Products: A Multitasking Modeling Approach
Applied Sciences·2025· 3 citedOpen Access
Artificial Intelligence-Driven Modeling for Hydrogel Three-Dimensional Printing: Computational and Experimental Cases of Study
Polymers·2025· 14 citedOpen Access
Biological cellular structures used in biosensors
Elsevier eBooks·2025
Targeting Nafld and Nash with Tinospora Crispa: Insights from Network Pharmacology and Molecular Dynamics
SSRN Electronic Journal·2025Open Access
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Frequent Co-authors

Tarun Jha(22), M. Natália D. S. Cordeiro(21), Nilanjan Adhikari(11), Achintya Saha(9), Chanchal Mondal(5), Nilanjan Ghosh(4), Reza Haghbakhsh(3), Ana Rita C. Duarte(3), Ana S. Moura(3), Krishna Das Saha(3), Shuvam Sar(3), Soumya Mitra(3), Parthasarathi Panda(3), Subhash C. Mandal(3), Pravin Ambure(2), Humberto González‐Díaz(2), Sumana Mallick(2), Yadu Nandan Dey(2), Iuliia V. Voroshylova(2), Sk. Abdul Amin(2)