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Biswajit Sadhu - Publications

Affiliations: 
Bhabha Atomic Research Centre, Mumbai, Maharashtra, India 
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23 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Story B, Sadhu B, Adams H, Clark AE. Additive energy functions have predictable landscape topologies. The Journal of Chemical Physics. 158. PMID 37096849 DOI: 10.1063/5.0140667  0.477
2022 Sadhu B, Clark AE. Modulating Aggregation in Microemulsions: The Dispersion by Competitive Intermolecular Interaction Model. The Journal of Physical Chemistry Letters. 13: 10981-10987. PMID 36404619 DOI: 10.1021/acs.jpclett.2c02658  0.495
2021 Patra K, Sadhu B, Sengupta A, Patil CB, Mishra RK, Kaushik CP. Achieving highly efficient and selective cesium extraction using 1,3-di-octyloxycalix[4]arene-crown-6 in -octanol based solvent system: experimental and DFT investigation. Rsc Advances. 11: 21323-21331. PMID 35478782 DOI: 10.1039/d1ra02661e  0.306
2020 Sadhu B, Dolg M, Kulkarni MS. Periodic trends and complexation chemistry of tetravalent actinide ions with a potential actinide decorporation agent 5-LIO(Me-3,2-HOPO): A relativistic density functional theory exploration. Journal of Computational Chemistry. 41: 1427-1435. PMID 32125003 DOI: 10.1002/Jcc.26186  0.481
2019 Sadhu B, Dolg M. Enhancing Actinide(III) over Lanthanide(III) Selectivity through Hard-by-Soft Donor Substitution: Exploitation and Implication of Near-Degeneracy-Driven Covalency. Inorganic Chemistry. 58: 9738-9748. PMID 31343876 DOI: 10.1021/Acs.Inorgchem.9B00705  0.44
2019 Ali M, Sadhu B, Boda A, Tiwari N, Das A, Musharaf Ali SK, Bhattacharya D, Pandey BN, Kumar A. Thorium decorporation efficacy of rationally-selected biocompatible compounds with relevance to human application. Journal of Hazardous Materials. 365: 952-961. PMID 30616306 DOI: 10.1016/J.Jhazmat.2018.11.038  0.32
2018 Sadhu B, Mishra V. The coordination chemistry of lanthanide and actinide metal ions with hydroxypyridinone-based decorporation agents: orbital and density based analyses. Dalton Transactions (Cambridge, England : 2003). PMID 30417921 DOI: 10.1039/C8Dt03262A  0.484
2017 Kannan S, Kumar M, Sadhu B, Jaccob M, Sundararajan M. Unusual intramolecular CHO hydrogen bonding interaction between a sterically bulky amide and uranyl oxygen. Dalton Transactions (Cambridge, England : 2003). PMID 29171845 DOI: 10.1039/C7Dt02760E  0.63
2017 Sadhu B, Sundararajan M, Bandyopadhyay T. Divalent ions are potential permeating blockers of the non-selective NaK ion channel: combined QM and MD based investigations. Physical Chemistry Chemical Physics : Pccp. PMID 28981131 DOI: 10.1039/C7Cp05586B  0.651
2017 Sadhu B, Sundararajan M, Pillai A, Singh R, Bandyopadhyay T. Selective separation of strontium by multitopic ion-pair receptor: A DFT exploration International Journal of Quantum Chemistry. 117: e25418. DOI: 10.1002/Qua.25418  0.653
2017 Khungar B, Roy A, Kumar A, Sadhu B, Sundararajan M. Predicting the redox properties of uranyl complexes using electronic structure calculations International Journal of Quantum Chemistry. 117: e25370. DOI: 10.1002/Qua.25370  0.593
2016 Kumar P, Jaison PG, Telmore VM, Sadhu B, Sundararajan M. Speciation of Uranium-Mandelic Acid Complexes using Electrospray Ionization Mass Spectrometry and Density Functional Theory. Rapid Communications in Mass Spectrometry : Rcm. PMID 28035726 DOI: 10.1002/Rcm.7817  0.61
2016 Sadhu B, Sundararajan M. Asn47 and Phe114 modulate the inner sphere reorganization energies of type zero copper proteins. Physical Chemistry Chemical Physics : Pccp. PMID 27271560 DOI: 10.1039/C6Cp00747C  0.585
2016 Vats BG, Das D, Sadhu B, Kannan S, Pius IC, Noronha DM, Sundararajan M, Kumar M. Selective recognition of uranyl ions from bulk of thorium(iv) and lanthanide(iii) ions by tetraalkyl urea: a combined experimental and quantum chemical study. Dalton Transactions (Cambridge, England : 2003). PMID 27241102 DOI: 10.1039/C6Dt01191H  0.668
2016 Sadhu B, Sundararajan M, Bandyopadhyay T. Efficient Separation of Europium Over Americium Using Cucurbit-[5]-uril Supramolecule: A Relativistic DFT Based Investigation. Inorganic Chemistry. PMID 26741954 DOI: 10.1021/Acs.Inorgchem.5B01627  0.692
2016 Kumar P, Jaison PG, Telmore VM, Alamelu D, Aggarwal SK, Sadhu B, Sundararajan M. Gas phase reactions of uranyl with α-hydroxyisobutyric acid using electrospray ionization mass spectrometry and density functional theory Journal of Radioanalytical and Nuclear Chemistry. 308: 303-310. DOI: 10.1007/S10967-015-4664-6  0.604
2015 Sadhu B, Sundararajan M, Bandyopadhyay T. Selectivity of a Singly Permeating Ion in Nonselective NaK Channel: Combined QM and MD Based Investigations. The Journal of Physical Chemistry. B. 119: 12783-97. PMID 26377764 DOI: 10.1021/Acs.Jpcb.5B05996  0.656
2015 Sadhu B, Sundararajan M, Velmurugan G, Venuvanalingam P. Elucidating the structures and cooperative binding mechanism of cesium salts to the multitopic ion-pair receptor through density functional theory calculations. Dalton Transactions (Cambridge, England : 2003). 44: 15450-62. PMID 26227949 DOI: 10.1039/C5Dt01095K  0.666
2015 Sadhu B, Sundararajan M, Bandyopadhyay T. Water-Mediated Differential Binding of Strontium and Cesium Cations in Fulvic Acid. The Journal of Physical Chemistry. B. 119: 10989-97. PMID 25794241 DOI: 10.1021/Acs.Jpcb.5B01659  0.66
2014 Verma PK, Pathak PN, Kumari N, Sadhu B, Sundararajan M, Aswal VK, Mohapatra PK. Effect of successive alkylation of N,N-dialkyl amides on the complexation behavior of uranium and thorium: solvent extraction, small angle neutron scattering, and computational studies. The Journal of Physical Chemistry. B. 118: 14388-96. PMID 25422857 DOI: 10.1021/Jp5074285  0.672
2014 Verma PK, Kumari N, Pathak PN, Sadhu B, Sundararajan M, Aswal VK, Mohapatra PK. Investigations on preferential Pu(IV) extraction over U(VI) by N,N-dihexyloctanamide versus tri-n-butyl phosphate: evidence through small angle neutron scattering and DFT studies. The Journal of Physical Chemistry. A. 118: 3996-4004. PMID 24815040 DOI: 10.1021/Jp503037Q  0.643
2013 Verma PK, Pathak PN, Mohapatra PK, Aswal VK, Sadhu B, Sundararajan M. An insight into third-phase formation during the extraction of thorium nitrate: evidence for aggregate formation from small-angle neutron scattering and validation by computational studies. The Journal of Physical Chemistry. B. 117: 9821-8. PMID 23895623 DOI: 10.1021/Jp4063548  0.627
2013 Khorwal V, Sadhu B, Dey A, Sundararajan M, Datta A. Modulation of protonation-deprotonation processes of 2-(4'-pyridyl)benzimidazole in its inclusion complexes with cyclodextrins. The Journal of Physical Chemistry. B. 117: 8603-10. PMID 23730970 DOI: 10.1021/Jp403476N  0.596
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