Reciprocal carbonyl-carbonyl interactions in small molecules and proteins
Rahim, Abdur, Saha, Pinaki, Jha, Kunal Kumar, Sukumar, Nagamani, Sarma, Bani Kanta
Published in Nature communications (19.07.2017)
Published in Nature communications (19.07.2017)
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Journal Article
Interplay of the intermolecular and intramolecular interactions in stabilizing the thione-based copper(I) complexes and their significance in protecting the biomolecules against metal-mediated oxidative damage
Chalana, Ashish, Kumar Rai, Rakesh, Karri, Ramesh, Kumar Jha, Kunal, Kumar, Binayak, Roy, Gouriprasanna
Published in Polyhedron (15.03.2022)
Published in Polyhedron (15.03.2022)
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Journal Article
Solvatochromism and Reversible Solvent Exchange Phenomena in Solvatomorphic Organic Chromophore Crystals
Jha, Kunal Kumar, Kumar, Anil, Munshi, Parthapratim
Published in Crystal growth & design (05.04.2023)
Published in Crystal growth & design (05.04.2023)
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Journal Article
Aspherical atom refinements on X‐ray data of diverse structures including disordered and covalent organic framework systems: a time–accuracy trade‐off
Jha, Kunal Kumar, Kleemiss, Florian, Chodkiewicz, Michał Leszek, Dominiak, Paulina Maria
Published in Journal of applied crystallography (01.02.2023)
Published in Journal of applied crystallography (01.02.2023)
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Journal Article
Isostructural polymorphs: qualitative insights from energy frameworks
Jha, Kunal Kumar, Dutta, Sanjay, Kumar, Vijay, Munshi, Parthapratim
Published in CrystEngComm (2016)
Published in CrystEngComm (2016)
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Journal Article
Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Restructurization and Extension of UBDB
Jha, Kunal Kumar, Gruza, Barbara, Sypko, Aleksandra, Kumar, Prashant, Chodkiewicz, Michał Leszek, Dominiak, Paulina Maria
Published in Journal of chemical information and modeling (22.08.2022)
Published in Journal of chemical information and modeling (22.08.2022)
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Journal Article
Activation of the Hg–C Bond of Methylmercury by [S2]‑Donor Ligands
Karri, Ramesh, Banerjee, Mainak, Chalana, Ashish, Jha, Kunal Kumar, Roy, Gouriprasanna
Published in Inorganic chemistry (16.10.2017)
Published in Inorganic chemistry (16.10.2017)
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Journal Article
Harnessing sun for catalyst and sensitizer free regio- and stereo-selective [2+2] cycloaddition
Jha, Kunal Kumar, Dutta, Sanjay, Sar, Saibal, Sen, Subhabrata, Munshi, Parthapratim
Published in Tetrahedron (20.12.2018)
Published in Tetrahedron (20.12.2018)
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Journal Article
TAAM refinement on high‐resolution experimental and simulated 3D ED/MicroED data for organic molecules
Kumar, Anil, Jha, Kunal Kumar, Olech, Barbara, Goral, Tomasz, Malinska, Maura, Woźniak, Krzysztof, Dominiak, Paulina Maria
Published in Acta crystallographica. Section C, Crystal structure communications (01.07.2024)
Published in Acta crystallographica. Section C, Crystal structure communications (01.07.2024)
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Journal Article
TAAM: a reliable and user friendly tool for hydrogen‐atom location using routine X‐ray diffraction data
Jha, Kunal Kumar, Gruza, Barbara, Kumar, Prashant, Chodkiewicz, Michal Leszek, Dominiak, Paulina Maria
Published in Acta crystallographica. Section B, Structural science (01.06.2020)
Published in Acta crystallographica. Section B, Structural science (01.06.2020)
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Journal Article
Topology of electron density and electrostatic potential of HIV reverse transcriptase inhibitor zidovudine from high resolution X-ray diffraction and charge density analysis
Iruthayaraj, Ancy, Chinnasamy, Kalaiarasi, Jha, Kunal Kumar, Munshi, Parthapratim, Pavan, Mysore S., Kumaradhas, Poomani
Published in Journal of molecular structure (15.03.2019)
Published in Journal of molecular structure (15.03.2019)
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Journal Article
Copper-Driven Deselenization: A Strategy for Selective Conversion of Copper Ion to Nanozyme and Its Implication for Copper-Related Disorders
Chalana, Ashish, Karri, Ramesh, Das, Ranajit, Kumar, Binayak, Rai, Rakesh Kumar, Saxena, Himani, Gupta, Ashish, Banerjee, Mainak, Jha, Kunal Kumar, Roy, Gouriprasanna
Published in ACS applied materials & interfaces (06.02.2019)
Published in ACS applied materials & interfaces (06.02.2019)
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Journal Article
Moving quantum crystallography from sub-atomic XRD to near-atomic 3D-ED
Dominiak, Paulina Maria, Chodkiewicz, Michał Leszek, Gruza, Barbara, Jha, Kunal Kumar, Kulik, Marta, Rybicka, Paulina, Sypko, Aleksandra
Published in Acta crystallographica. Section A, Foundations and advances (14.08.2021)
Published in Acta crystallographica. Section A, Foundations and advances (14.08.2021)
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Journal Article
Synthesis of novel 5-arylidenethiazolidinones with apoptotic properties via a three component reaction using piperidine as a bifunctional reagent
Bathula, Chandramohan, Tripathi, Sayantan, Srinivasan, Ramprasad, Jha, Kunal Kumar, Ganguli, Arnab, Chakrabarti, G., Singh, Shailja, Munshi, Parthapratim, Sen, Subhabrata
Published in Organic & biomolecular chemistry (01.01.2016)
Published in Organic & biomolecular chemistry (01.01.2016)
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Journal Article
Identification of Leishmania donovani Topoisomerase 1 inhibitors via intuitive scaffold hopping and bioisosteric modification of known Top 1 inhibitors
Mamidala, Rajinikanth, Majumdar, Papiya, Jha, Kunal Kumar, Bathula, Chandramohan, Agarwal, Rahul, Chary, M Thirumala, Mazumdar, H K, Munshi, Parthapratim, Sen, Subhabrata
Published in Scientific reports (25.05.2016)
Published in Scientific reports (25.05.2016)
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Journal Article
Synthesis of novel 5-arylidenethiazolidinones with apoptotic properties via a three component reaction using piperidine as a bifunctional reagentElectronic supplementary information (ESI) available. CCDC 1453249-1453259. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c6ob01257d
Bathula, Chandramohan, Tripathi, Sayantan, Srinivasan, Ramprasad, Jha, Kunal Kumar, Ganguli, Arnab, Chakrabarti, G, Singh, Shailja, Munshi, Parthapratim, Sen, Subhabrata
Year of Publication 25.08.2016
Year of Publication 25.08.2016
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Journal Article