Insights into the interaction between polyphenols and β-lactoglobulin through molecular docking, MD simulation, and QM/MM approaches I Baruah, C Kashyap, AK Guha, G Borgohain ACS omega 7 (27), 23083-23095, 2022 | 18 | 2022 |
Planar Pentacoordinate Nitrogen in a Pseudo-Double-Aromatic NBe5H4+ Cluster AJ Kalita, SS Rohman, C Kashyap, SS Ullah, I Baruah, AK Guha Inorganic Chemistry 59 (24), 17880-17883, 2020 | 13 | 2020 |
Endocrine disruption: molecular interactions of chlorpyrifos and its degradation products with estrogen receptor J Hazarika, M Ganguly, G Borgohain, I Baruah, S Sarma, P Bhuyan, ... Structural Chemistry 31, 2011-2021, 2020 | 11 | 2020 |
Alpha glucosidase inhibitory properties of a few bioactive compounds isolated from black rice bran: combined in vitro and in silico evidence supporting the antidiabetic effect … P Bhuyan, M Ganguly, I Baruah, G Borgohain, J Hazarika, S Sarma RSC advances 12 (35), 22650-22661, 2022 | 10 | 2022 |
Structural and functional changes of the protein β-lactoglobulin under thermal and electrical processing conditions I Baruah, G Borgohain Biophysical Chemistry 267, 106479, 2020 | 10 | 2020 |
Planar pentacoordinate zinc group elements stabilized by multicentric bonds AJ Kalita, I Baruah, K Sarmah, RR Borah, F Yashmin, AK Guha Inorganic Chemistry 61 (3), 1259-1263, 2022 | 8 | 2022 |
Is a transition metal–silicon quadruple bond viable? AJ Kalita, SS Rohman, C Kashyap, SS Ullah, I Baruah, LJ Mazumder, ... Physical Chemistry Chemical Physics 23 (16), 9660-9662, 2021 | 8 | 2021 |
σ-Aromaticity in planar pentacoordinate aluminium and gallium clusters AJ Kalita, K Sarmah, F Yashmin, RR Borah, I Baruah, RP Deka, AK Guha Scientific Reports 12 (1), 10041, 2022 | 7 | 2022 |
Binding interaction of a potential statin with β-lactoglobulin: An in silico approach I Baruah, G Borgohain Journal of Molecular Graphics and Modelling 111, 108077, 2022 | 6 | 2022 |
Unsupported Donor–Acceptor Complexes of Noble Gases with Group 13 Elements LJ Mazumder, AJ Kalita, SS Rohman, C Kashyap, SS Ullah, I Baruah, ... ACS omega 6 (12), 8656-8661, 2021 | 6 | 2021 |
Boron–boron quadruple bond in Li 3 B 2− and Li 4 B 2 clusters AJ Kalita, SS Rohman, C Kashyap, SS Ullah, I Baruah, LJ Mazumder, ... Physical Chemistry Chemical Physics 23 (37), 20985-20988, 2021 | 5 | 2021 |
Temperature dependent molecular dynamics simulation study to understand the stabilizing effect of NADES on the protein β-Lactoglobulin I Baruah, G Borgohain Journal of Molecular Graphics and Modelling 125, 108582, 2023 | 2 | 2023 |
Neutral all metal aromatic half-sandwich complexes between alkaline earth and transition metals: an ab initio exploration AJ Kalita, PP Sahu, RR Borah, SS Rohman, C Kashyap, SS Ullah, ... Structural Chemistry 32, 2313-2318, 2021 | 1 | 2021 |
Planar Octacoordinate Aluminium in Dual Aromatic AlBe4N4− Cluster AJ Kalita, SS Rohman, C Kashyap, SS Ullah, I Baruah, LJ Mazumder, ... Journal of Cluster Science 34 (2), 1133-1139, 2023 | | 2023 |
Metallic clusters for realizing planar hypercoordinate second-row main group elements and multiple bonded species AJ Kalita, SS Rohman, C Kashyap, LJ Mazumder, I Baruah, RR Borah, ... Atomic Clusters with Unusual Structure, Bonding and Reactivity, 345-355, 2023 | | 2023 |
Planar Pentacoordinate Aluminium and Gallium Atoms F Yashmin, AJ Kalita, RR Borah, I Baruah, RP Deka, AK Guha | | 2022 |
In silico search for planar hexacoordinate silicon atom: A kinetically viable species AJ Kalita, SS Rohman, C Kashyap, SS Ullah, I Baruah, LJ Mazumder, ... International Journal of Quantum Chemistry 121 (14), e2664, 2021 | | 2021 |
Theoretical study on CO2 hydrogenation mediated by Ru-PNP pincer complexes: An implication towards rational catalyst design SS Rohman, C Kashyap, AJ Kalita, SS Ullah, I Baruah, LJ Mazumder, ... Journal of Organometallic Chemistry 943, 121842, 2021 | | 2021 |
Carbonyl oxide chemistry in water cluster: An extended computational study C Kashyap, I Baruah, SS Rohman, SS Ullah, AJ Kalita, G Borgohain, ... International Journal of Quantum Chemistry 120 (23), e26386, 2020 | | 2020 |