| Permeation of nanoparticles across the intestinal lipid membrane: dependence on shape and surface chemistry studied through molecular simulations R Gupta, Y Badhe, S Mitragotri, B Rai Nanoscale 12 (11), 6318-6333, 2020 | 62 | 2020 |
| Molecular mechanism of the skin permeation enhancing effect of ethanol: A molecular dynamics study R Gupta, Y Badhe, B Rai, S Mitragotri RSC advances 10 (21), 12234-12248, 2020 | 47 | 2020 |
| Structural and barrier properties of the skin ceramide lipid bilayer: a molecular dynamics simulation study Y Badhe, R Gupta, B Rai Journal of molecular modeling 25 (5), 140, 2019 | 26 | 2019 |
| In silico design of peptides with binding to the receptor binding domain (RBD) of the SARS-CoV-2 and their utility in bio-sensor development for SARS-CoV-2 detection Y Badhe, R Gupta, B Rai RSC advances 11 (7), 3816-3826, 2021 | 23 | 2021 |
| Investigating the nanostructure of a CER [NP]/CER [AP]-based stratum corneum lipid matrix model: A combined neutron diffraction & molecular dynamics simulations approach Y Badhe, T Schmitt, R Gupta, B Rai, RHH Neubert Biochimica et Biophysica Acta (BBA)-Biomembranes 1864 (10), 184007, 2022 | 8 | 2022 |
| Development and application of coarse-grained MARTINI model of skin lipid ceramide [AP] Y Badhe, R Gupta, B Rai Journal of Molecular Modeling 26 (7), 182, 2020 | 5 | 2020 |
| Interactions of peptide coated gold nanoparticles with spike protein of the SARS-CoV-2: a basis for design of a simple and rapid detection tool N Verma, Y Badhe, R Gupta, A Maparu, B Rai | 4 | 2020 |
| Peptide mediated colorimetric detection of SARS-CoV-2 using gold nanoparticles: a molecular dynamics simulation study N Verma, Y Badhe, R Gupta, AK Maparu, B Rai Journal of Molecular Modeling 28 (7), 202, 2022 | 3 | 2022 |
| Elucidating collective translocation of nanoparticles across the skin lipid matrix: a molecular dynamics study Y Badhe, P Sharma, R Gupta, B Rai Nanoscale Advances 5 (7), 1978-1989, 2023 | 1 | 2023 |
| Modeling the effect of pH on the permeability of dried chitosan film P Kedia, Y Badhe, R Gupta, S Kausley, B Rai Journal of Food Engineering 358, 111682, 2023 | | 2023 |
| An insilico design of a peptide bioreceptor for cortisol using molecular modelling techniques P Deshpande, D De, Y Badhe, S Tallur, D Paul, B Rai | | 2023 |
| Coarse Grained MD Simulation of Bulk and Interfacial Behavior of Mixture of CTAB/SDS Surfactants Y Badhe, D Kumar, R Gupta, V Jain, B Rai | | 2023 |
| Investigating the Nanostructure of the Stratum Corneum Lipid Matrix: A Combined Neutron Diffraction & Molecular Dynamics Simulations Approach Y Badhe, T Schmitt, R Gupta, B Rai, RHH Neubert | | 2022 |
| Method and system for insilico design and testing of formulations using physiochemical skin model H Jayabal, N Verma, P Sharma, K Gajula, NN Dingari, YK Badhe, ... US Patent App. 16/745,970, 2020 | | 2020 |
beena raiTata research development and design centreVerified email at tcs.com
