B. Dehury

Pradeep Das, Md. Yousuf Ansari, Bikash R. Sahoo, 2016, Infection, genetics and evolution : journal of molecular epidemiology and evolutionary genetics in infectious diseases.

Metagenomics study in aquatic resource management: Recent trends, applied methodologies and future needs

N. Mantri, A. Rai, B. Dehury, 2021, Gene Reports.

Delineation of molecular interactions of plant growth promoting bacteria induced β-1,3-glucanases and guanosine triphosphate ligand for antifungal response in rice: a molecular dynamics approach

J. Simal-Gándara, M. Yadav, Sunil Kumar, 2021, Molecular Biology Reports.

Designing an efficient multi-epitope vaccine displaying interactions with diverse HLA molecules for an efficient humoral and cellular immune response to prevent COVID-19 infection

M. Suar, B. Dehury, Namrata Misra, 2020, Expert review of vaccines.

Molecular Modeling and Dynamics Simulation Analysis of KATNAL1 for Identification of Novel Inhibitor of Sperm Maturation.

M. Modi, Saurav Das, B. Dehury, 2017, Combinatorial chemistry & high throughput screening.

Computing the Pathogenicity of Alzheimer's Disease Presenilin 1 Mutations

Ning Tang, Budheswar Dehury, Kasper P Kepp, 2019, J. Chem. Inf. Model..

Molecular characterization and structural dynamics of Aquaporin1 from walking catfish in lipid bilayers.

B. Dehury, B. Behera, J. Parhi, 2021, International journal of biological macromolecules.

In silico identification and characterization of conserved miRNAs and their target genes in sweet potato (Ipomoea batatas L.) Expressed Sequence Tags (ESTs)

D. Panda, M. Modi, B. Dehury, 2013 .

Computational identification and characterization of conserved miRNAs and their target genes in garlic (Allium sativum L.) expressed sequence tags.

D. Panda, M. Modi, B. Dehury, 2014, Gene.

NEW INSIGHTS INTO THE GUT MICROBIOME RESEARCH TO UNDERSTAND THE MICROBIAL DIVERSITY OF INDIAN AND WESTERN POPULATIONS WITH TYPE II DIABETES MELLITUS: A SHORT REVIEW

Namita, S. Kar, B. Dehury, 2017 .

Structural bioinformatics insights into ATP binding mechanism in zebrafish (Danio rerio) cyclin‐dependent kinase‐like 5 (zCDKL5) protein

B. Dehury, B. Das, B. Behera, 2019, Journal of cellular biochemistry.

Structural and dynamic investigation of bovine folate receptor alpha (FOLR1), and role of ultra-high temperature processing on conformational and thermodynamic characteristics of FOLR1-folate complex.

Bikash R. Sahoo, S. K. Pradhan, S. K. Lenka, 2014, Colloids and surfaces. B, Biointerfaces.

Taxonomic profiling and functional gene annotation of microbial communities in sediment of river Ganga at Kanpur, India: insights from whole-genome metagenomics study

B. Dehury, B. Behera, D. Sarkar, 2022, Environmental Science and Pollution Research.

Novel insights into the dynamics behavior of glucagon-like peptide-1 receptor with its small molecule agonists

Surbhi Dogra, Abhinav Choubey, P. Mondal, 2018, Journal of biomolecular structure & dynamics.

Computer-aided synthesis of dapsone-phytochemical conjugates against dapsone-resistant Mycobacterium leprae

B. Dehury, S. S. Swain, R. Padhy, 2020, Scientific Reports.

Kanamycin-Mediated Conformational Dynamics of Escherichia coli Outer Membrane Protein TolC

B. Dehury, S. Jha, T. Beuria, 2021, Frontiers in Molecular Biosciences.

Structure-Based Computational Study of Two Disease Resistance Gene Homologues (Hm1 and Hm2) in Maize (Zea mays L.) with Implications in Plant-Pathogen Interactions

M. Modi, M. C. Patra, B. Dehury, 2014, PloS one.

Understanding the thermal response of rice eukaryotic transcription factor eIF4A1 towards dynamic temperature stress: insights from expression profiling and molecular dynamics simulation

D. Panda, M. Modi, B. Dehury, 2020, Journal of biomolecular structure & dynamics.

Structural and functional investigation of zebrafish (Danio rerio) NOD1 leucine rich repeat domain and its interaction with iE-DAP.

Bijay Kumar Behera, Aritra Bej, Bikash R. Sahoo, 2014, Molecular bioSystems.

Structural bioinformatics insights into the CARD‐CARD interaction mediated by the mitochondrial antiviral‐signaling protein of black carp

B. Dehury, B. Das, B. Behera, 2019, Journal of cellular biochemistry.

The potential HLA Class I-restricted epitopes derived from LeIF and TSA of Leishmania donovani evoke anti-leishmania CD8+ T lymphocyte response

G. Sahoo, B. Dehury, M. Dikhit, 2018, Scientific Reports.

Insights into structure and dynamics of extracellular domain of Toll-like receptor 5 in Cirrhinus mrigala (mrigala): A molecular dynamics simulation approach

B. Dehury, B. Behera, Bhaskar Behera, 2021, PloS one.

Molecular cloning, GTP recognition mechanism and tissue-specific expression profiling of myxovirus resistance (Mx) protein in Labeo rohita (Hamilton) after Poly I:C induction

B. Dehury, B. Das, B. Behera, 2019, Scientific Reports.

Deep insights into the mode of ATP-binding mechanism in Zebrafish cyclin-dependent protein kinase-like 1 (zCDKL1): A molecular dynamics approach.

C. Nayak, B. Dehury, B. Das, 2018, Journal of molecular graphics & modelling.

Mining and comparative survey of EST–SSR markers among members of Euphorbiaceae family

B. Dehury, J. Sahu, Surojit Sen, 2018, Molecular Biology Reports.

In silico mining and characterization of simple sequence repeats (SSRs) from Euphorbia esula expressed sequence tags (ESTs): A potential crop for biofuel

B. Dehury, J. Sahu, Surojit Sen, 2017 .

Novel insights into structure–function mechanism and tissue-specific expression profiling of full-length dxr gene from Cymbopogon winterianus

M. Modi, B. Dehury, P. Sen, 2015, FEBS open bio.

Cryo-temperature effects on membrane protein structure and dynamics.

K. P. Kepp, B. Dehury, Rukmankesh Mehra, 2020, Physical chemistry chemical physics : PCCP.

Structure and dynamics of γ-secretase with presenilin 2 compared to presenilin 1

T. Blundell, N. Tang, K. P. Kepp, 2019, RSC advances.

Genome Wide Screening, Identification and Characterization of NAC Transcription Factors from Capsicum Species: An In Silico Approach

B. Dehury, S. Mandal, Ayushman Gadnayak, 2016 .

Comprehensive sequence and structure analysis of algal lipid catabolic enzyme Triacylglycerol lipase: an in silico study to vitalize the development of optimum engineered strains with high lipid productivity

Parminder Kaur Narang, M. Suar, B. Dehury, 2021, Journal of biomolecular structure & dynamics.

Identification of phytocompounds as newer antiviral drugs against COVID-19 through molecular docking and simulation based study

D. Bhattacharya, B. Dehury, S. Pati, 2022, Journal of Molecular Graphics and Modelling.

‘Mechanistic insights into 5-lipoxygenase inhibition by active principles derived from essential oils of Curcuma species: Molecular docking, ADMET analysis and molecular dynamic simulation study

A. Ray, S. Jena, A. Sahoo, 2022, PloS one.

Drug repurposing for Mpox: Discovery of small molecules as potential inhibitors against DNA‐dependent RNA polymerase using molecular modeling approach

D. Kelvin, Pacifique Ndishimye, B. Dehury, 2023, Journal of cellular biochemistry.

Exploiting the potential of natural polyphenols as antivirals against monkeypox envelope protein F13 using machine learning and all-atoms MD simulations

Mahender Kumar Singh, B. Dehury, Madhusmita Rout, 2023, Computers in biology and medicine.

Structural insights into SARS‐CoV‐2 main protease conformational plasticity

B. Dehury, S. Pati, Sarbani Mishra, 2023, Journal of cellular biochemistry.

Identification of potential inhibitor against CTX-M-3 and CTX-M-15 proteins: an in silico and in vitro study

C. Kundu, D. Bhattacharya, B. Dehury, 2023, Journal of biomolecular structure & dynamics.

Diet-induced induction of hepatic serine/threonine kinase STK38 triggers proinflammation and hepatic lipid accumulation

Surbhi Dogra, P. Mondal, B. Dehury, 2023, The Journal of biological chemistry.

In silico analyses of superoxide dismutases (SODs) of rice (Oryza sativa L.)

M. Modi, B. Dehury, R. Sarmah, 2012, Journal of Plant Biochemistry and Biotechnology.

Machine learning and classical MD simulation to identify inhibitors against the P37 envelope protein of monkeypox virus.

Mahender Kumar Singh, B. Dehury, Madhusmita Rout, 2023, Journal of biomolecular structure & dynamics.

Structural insights of Labeo catla (catla) myxovirus resistance protein,GTP binding recognition and constitutive expression induced with Poly I:C

B. Dehury, B. Behera, Pragyan Roy, 2023, Journal of biomolecular structure & dynamics.

Insights into the mode of flavin mononucleotide binding and catalytic mechanism of bacterial chromate reductases: A molecular dynamics simulation study

S. K. Pradhan, H. Thatoi, D. Panda, 2019, Journal of cellular biochemistry.

An immunoinformatic approach towards development of a potent and effective multi-epitope vaccine against monkeypox virus (MPXV)

B. Dehury, Madhusmita Rout, S. Pati, 2023, Journal of biomolecular structure & dynamics.

Exploring the role and diversity of mucins in health and disease with special insight into non-communicable diseases

B. Dehury, S. Negi, S. Behera, 2015, Glycoconjugate Journal.

Molecular cloning, GTP recognition mechanism and tissue-specific expression profiling of myxovirus resistance (Mx) protein in Labeo rohita (Hamilton) after Poly I:C induction

B. Dehury, B. Das, B. Behera, 2019, Scientific Reports.

The potential HLA Class I-restricted epitopes derived from LeIF and TSA of Leishmania donovani evoke anti-leishmania CD8+ T lymphocyte response

G. Sahoo, B. Dehury, P. Das, 2018, Scientific Reports.

Dissecting the Molecular Basis of Host Leucine-Rich Repeat Containing 15 Mediated Interaction with Receptor Binding Domain of SARS-CoV-2 Spike Protein: A Computational Approach.

B. Dehury, S. Pati, Sarbani Mishra, 2023, The journal of physical chemistry letters.

Computational saturation mutagenesis to explore the effect of pathogenic mutations on extra-cellular domains of TREM2 associated with Alzheimer’s and Nasu-Hakola disease

B. Dehury, S. Pati, Preety Sthutika Swain, 2023, Journal of Molecular Modeling.

SERF2, an RNA G-quadruplex Binding Protein, promotes stress granule formation

B. Dehury, Emi Miyashita, Bikash Sahoo, 2023, bioRxiv.

Exploiting the potential of natural polyphenols as antivirals against monkeypox envelope protein F13 using machine learning and all-atoms MD simulations

B. Dehury, Madhusmita Rout, S. Pati, 2023, Computers in Biology and Medicine.

Molecular dynamics insights into the structure, function, and substrate binding mechanism of mucin desulfating sulfatase of gut microbe Bacteroides fragilis

S. Kar, N. Mahapatra, B. Dehury, 2018, Journal of cellular biochemistry.

Computational insights into the binding mechanism of antagonists with neuropeptide B/W receptor 1.

M. C. Patra, B. Dehury, Jitendra Maharana, 2014, Molecular bioSystems.

Insights into the structure-function relationship of disease resistance protein HCTR in maize (Zea mays L.): a computational structural biology approach.

M. Modi, M. C. Patra, B. Dehury, 2013, Journal of molecular graphics & modelling.

Lipid and cholesterols modulate the dynamics of SARS-CoV-2 viral ion channel ORF3a and its pathogenic variants.

B. Dehury, Madhusmita Rout, S. Pati, 2023, International journal of biological macromolecules.

A review on structure-function mechanism and signaling pathway of serine/threonine protein PIM kinases as a therapeutic target.

S. K. Pradhan, B. Dehury, N. Kaushik, 2024, International journal of biological macromolecules.

Mining for SSRs and FDMs from expressed sequence tags of Camellia sinensis

Jagajjit Sahu, Priyabrata Sen, Madhumita Barooah, 2012, Bioinformation.

Molecular docking and MD simulations reveal protease inhibitors block the catalytic residues in Prp8 intein of Aspergillus fumigatus: a potential target for antimycotics.

B. Dehury, Madhusmita Rout, S. Pati, 2023, Journal of biomolecular structure & dynamics.

Spectroscopic insights with molecular docking and molecular dynamic simulation studies of anticancer drug 5-fluororouracil targeting human pyruvate kinase m2.

B. Dehury, Bairagi C Mallick, M. Priyadarshinee, 2024, Journal of biomolecular structure & dynamics.

Illuminating the structural basis of human neurokinin 1 receptor (NK1R) antagonism through classical all‐atoms molecular dynamics simulations

B. Dehury, Madhusmita Rout, S. Pati, 2023, Journal of cellular biochemistry.