| Specific inhibition of β-secretase processing of the Alzheimer disease amyloid precursor protein SB Halima, S Mishra, KMP Raja, M Willem, A Baici, K Simons, O Brüstle, ... Cell reports 14 (9), 2127-2141, 2016 | 131 | 2016 |
| Atomistic simulation of NO dioxygenation in group I truncated hemoglobin S Mishra, M Meuwly Journal of the American Chemical Society 132 (9), 2968-2982, 2010 | 55 | 2010 |
| The relativistic E× E Jahn–Teller effect revisited W Domcke, S Mishra, LV Poluyanov Chemical physics 322 (3), 405-410, 2006 | 54 | 2006 |
| Nitric oxide dynamics in truncated hemoglobin: docking sites, migration pathways, and vibrational spectroscopy from molecular dynamics simulations S Mishra, M Meuwly Biophysical journal 96 (6), 2105-2118, 2009 | 36 | 2009 |
| Visible-Light-Activated Divergent Reactivity of Dienones: Dimerization in Neat Conditions and Regioselective E to Z Isomerization in the Solvent S Naskar, S Roy Chowdhury, S Mondal, DK Maiti, S Mishra, I Das Organic letters 21 (6), 1578-1582, 2019 | 33 | 2019 |
| Spin-orbit vibronic coupling in π3 states of linear triatomic molecules S Mishra, LV Poluyanov, W Domcke The Journal of chemical physics 126 (13), 2007 | 30 | 2007 |
| Structural Diversity of Copper (I) Complexes Formed by Pyrrole-and Dipyrrolylmethane-Based Diphosphine Ligands with Cu–X··· HN Hydrogen Bonds S Kumar, G Mani, D Dutta, S Mishra Inorganic Chemistry 53 (2), 700-709, 2014 | 28 | 2014 |
| Dynamics in the active site of β-secretase: a network analysis of atomistic simulations S Mishra, A Caflisch Biochemistry 50 (43), 9328-9339, 2011 | 25 | 2011 |
| Spectroscopic effects of first-order relativistic vibronic coupling in linear triatomic molecules S Mishra, V Vallet, LV Poluyanov, W Domcke The Journal of chemical physics 123 (12), 2005 | 25 | 2005 |
| Synthesis, structure, electrochemical, and spectroscopic properties of hetero-bimetallic Ru (II)/Fe (II)-alkynyl organometallic complexes A Sil, U Ghosh, VK Mishra, S Mishra, SK Patra Inorganic Chemistry 58 (2), 1155-1166, 2019 | 23 | 2019 |
| Structural and mechanistic insight into substrate binding from the conformational dynamics in apo and substrate-bound DapE enzyme D Dutta, S Mishra Physical Chemistry Chemical Physics 18 (3), 1671-1680, 2016 | 22 | 2016 |
| Importance of spin–orbit Coupling for the Assignment of the Photodetachment Spectra of AuX2−(X= Cl, Br, and I) S Mishra, V Vallet, W Domcke ChemPhysChem 7 (3), 723-727, 2006 | 22 | 2006 |
| Diruthenium (II)-capped oligothienylethynyl bridged highly soluble organometallic wires exhibiting long-range electronic coupling SS Roy, A Sil, D Giri, SR Chowdhury, S Mishra, SK Patra Dalton Transactions 47 (40), 14304-14317, 2018 | 21 | 2018 |
| Calculation of the vibronic structure of the X̃Π2 photoelectron spectra of XCN, X= F, Cl, and Br S Mishra, V Vallet, LV Poluyanov, W Domcke The Journal of chemical physics 124 (4), 2006 | 21 | 2006 |
| The structural and energetic aspects of substrate binding and the mechanism of action of the DapE-encoded N-succinyl-L, L-diaminopimelic acid desuccinylase (DapE) investigated … D Dutta, S Mishra Physical Chemistry Chemical Physics 16 (47), 26348-26358, 2014 | 20 | 2014 |
| Quantitative analysis of ligand migration from transition networks S Mishra, M Meuwly Biophysical journal 99 (12), 3969-3978, 2010 | 18 | 2010 |
| A novel PEGylated block copolymer in new age therapeutics for Alzheimer’s disease S Som Chaudhury, A Sannigrahi, M Nandi, VK Mishra, P De, ... Molecular Neurobiology 56, 6551-6565, 2019 | 17 | 2019 |
| L-Captopril and its derivatives as potential inhibitors of microbial enzyme DapE: a combined approach of drug repurposing and similarity screening D Dutta, S Mishra Journal of Molecular Graphics and Modelling 84, 82-89, 2018 | 16 | 2018 |
| Carboxylate Coordination Assisted Aggregation for Quasi‐Tetrahedral and Partial‐Dicubane [Cu4] Coordination Clusters TS Mahapatra, A Bauzá, D Dutta, S Mishra, A Frontera, D Ray ChemistrySelect 1 (1), 64-75, 2016 | 15 | 2016 |
| Self‐Assembling Behaviour of Perylene, Perylene Diimide, and Thionated Perylene Diimide Deciphered through Non‐Covalent Interactions S Parida, SK Patra, S Mishra ChemPhysChem 23 (23), e202200361, 2022 | 14 | 2022 |
Wolfgang DomckeProfessor of Theoretical Chemistry, Technical University of Munich在 ch.tum.de 的电子邮件经过验证
