Sayan Paul @Sayan98_iitkgp
Research Scholar@IIT Kharagpur Joined January 2022-
Tweets46
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Following201
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Planarity Is Not Plain: Closed- vs Open-Shell Reactivity of a Structurally Constrained, Doubly Reduced Arylborane toward Fluorobenzenes | Journal of the American Chemical Society pubs.acs.org/doi/10.1021/ja…
Paul Dirac on how to get good ideas: don't strive for them, be relaxed, go for a long walk.
SynTemp: Efficient Extraction of Graph-Based Reaction Rules from Large-Scale Reaction Databases pubs.acs.org/doi/10.1021/ac… #JCIM Vol65 Issue6 #compchem
“No government—regardless of which party is in power—should dictate what private universities can teach, whom they can admit and hire, and which areas of study and inquiry they can pursue.” - President Alan Garber hrvd.me/GarberRespond3…
π-Complexes Derived from Non-classical Diboriranes: Side-on vs. End-on Carbonylative Ring Expansion (@angew_chem): onlinelibrary.wiley.com/doi/10.1002/an… (@scheschkewitz).
Accurate Prediction of ωB97X-D/6-31G* Equilibrium Geometries from a Neural Net Starting from Merck Molecular Force Field (MMFF) Molecular Mechanics Geometries pubs.acs.org/doi/10.1021/ac… @Wavefunction #JCIM Vol65 Issue5 #MachineLearning #DeepLearning
A simple guide to the design of metal complexes in luminescence and photoredox catalysis. With @GiacomoMorsell2 and @reber_christian in @J_A_C_S: pubs.acs.org/doi/10.1021/ja…
Implicating the Role of Au-H Bonds in Photochemical N2 Fixation by Ruthenium-Doped Gold Clusters (Ankan Paul and co-workers @Sayan98_iitkgp) • onlinelibrary.wiley.com/doi/10.1002/ch…
Here's a niche #Chemistry #ChemEd summary, assigning stereochemical descriptors to axial & equatorial chirality. I know some argue these phrases are meaningless, but they're terms used by synthetic chemists. I know others just hate stereochemistry (you weirdos)! Hope it is useful
A fascinating piece of review on antiaromaticity in molecular assemblies and materials from Dr Lavendomme @RoyLavendomme and Dr Yamashina 豊田研 @sciencetokyo_ja 👨🔬🧑🔬 👉pubs.rsc.org/en/content/art…
New in Angewandte Chemie! 🚀 Lattice modulation boosts #TADF - driven PLQY of #SilverClusters to near-unity! Thanks, @DiSun83 for collaboration & @Sayan98_iitkgp for #compchem work. Read more: doi.org/10.1002/anie.2… #Photoluminescence #SilverClusters
Asymmetric Total Synthesis of Naturally Occurring (R)-2′-Methoxydihydroartemidin, (R)-(E)-3′-Hydroxyartemidin, and Its Structural Congeners: Method Optimization and Mechanistic Analysis | The Journal of Organic Chemistry pubs.acs.org/doi/10.1021/ac…
Riboflavin-Induced DNA Damage and Anticancer Activity in Breast Cancer Cells under Visible Light: A TD-DFT and In Vitro Study #breastcancer #DFT pubs.acs.org/doi/10.1021/ac… @ranabirju15 @ShreyaB95166320 @Sayan98_iitkgp @A_Anoop_A #JCIM Vol64 Issue14 #ChemicalInformation
Riboflavin-Induced DNA Damage and Anticancer Activity in Breast Cancer Cells under Visible Light: A TD-DFT and In Vitro Study | Journal of Chemical Information and Modeling pubs.acs.org/doi/10.1021/ac…
Potential Prebiotic Pathways in Extraterrestrial Atmosphere: A Computational Exploration of HCN and NH3 Reactions | ACS Earth and Space Chemistry pubs.acs.org/doi/10.1021/ac… @Sunanda12330798 @IITKgp @dukerala #compchem
"#Congratulations to Sunanda Panda for successfully defending her #PhD thesis! @Sunanda12330798 @IITKgp
Structure of Small Yttrium Monoxide Clusters, Chemical Bonding, and Photoionization: Threshold Photoionization and Density Functional Theory Investigations - now in PCCP pubs.rsc.org/en/content/art… Thanks to Soumen Bhattacharyya for inviting me to this collaboration. @dukerala
Exploring the Theoretical Foundations of Thermally Activated Delayed Fluorescence (TADF) Emission: A Comprehensive TD‐DFT Study on Phenothiazine Systems - Banerjee - Chemistry – A European Journal …mistry-europe.onlinelibrary.wiley.com/doi/10.1002/ch… @MoBanerjee1 @IITKgp @dukerala #compchem
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Subhrashis Banerjee �... @SubhrashisB
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ICQC2023 @icqc2023
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Harvard University @Harvard
1.7M Followers 725 Following Official account for Harvard University. Devoted to excellence in teaching, learning, and research, and to developing leaders who make a difference globally.
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Inorganic Chemistry @InorgChem
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ACS Publications @ACSPublications
65K Followers 994 Following ACS Publications is proud to publish the most trusted, most cited, and most read collection of peer-reviewed journals in the chemical and related sciences.
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