Molecular simulations of peptide amphiphiles A Manandhar, M Kang, K Chakraborty, PK Tang, SM Loverde Organic & biomolecular chemistry 15 (38), 7993-8005, 2017 | 46 | 2017 |
Targeting SARS-CoV-2 M3CLpro by HCV NS3/4a Inhibitors: In Silico Modeling and In Vitro Screening A Manandhar, BE Blass, DJ Colussi, I Almi, M Abou-Gharbia, ML Klein, ... Journal of chemical information and modeling 61 (2), 1020-1032, 2021 | 31 | 2021 |
Discovery of novel small-molecule inhibitors of SARS-CoV-2 main protease as potential leads for COVID-19 treatment A Manandhar, V Srinivasulu, M Hamad, H Tarazi, H Omar, DJ Colussi, ... Journal of Chemical Information and Modeling 61 (9), 4745-4757, 2021 | 15 | 2021 |
Rational Coarse-Grained Molecular Dynamics Simulations of Supramolecular Anticancer Nanotubes A Manandhar, K Chakraborty, PK Tang, M Kang, P Zhang, H Cui, ... The Journal of Physical Chemistry B 123 (50), 10582-10593, 2019 | 12 | 2019 |
Effect of nucleotide state on the protofilament conformation of tubulin octamers A Manandhar, M Kang, K Chakraborty, SM Loverde The Journal of Physical Chemistry B 122 (23), 6164-6178, 2018 | 9 | 2018 |
Potential Pro-Inflammatory Effect of Vitamin E Analogs through Mitigation of Tetrahydrocannabinol (THC) Binding to the Cannabinoid 2 Receptor A Manandhar, MH Haron, SA Ross, ML Klein, KM Elokely International Journal of Molecular Sciences 23 (8), 4291, 2022 | 5 | 2022 |
Redetermination and absolute configuration of (+)-7-epiclusianone OE Christian, FR Fronczek, K Ky, S Pradhan, A Manandhar, C Richmond Acta Crystallographica Section E: Structure Reports Online 68 (11), o3222-o3223, 2012 | 4 | 2012 |
Understanding the Dynamics of the Structural States of Cannabinoid Receptors and the Role of Different Modulators A Manandhar, MH Haron, ML Klein, K Elokely Life 12 (12), 2137, 2022 | 3 | 2022 |
The interaction of supramolecular anticancer drug amphiphiles with phospholipid membranes PK Tang, A Manandhar, W Hu, M Kang, SM Loverde Nanoscale advances 3 (2), 370-382, 2021 | 3 | 2021 |
Sequence dependence in nucleosome dynamics P Khatua, P Tang, AG Moulick, R Patel, A Manandhar, SM Loverde Biophysical Journal 123 (3), 137a, 2024 | 1 | 2024 |
Sequence Dependent Barriers to Nucleosome Unwrapping W Hu, P Tang, A Manandhar, K Chakraborty, SM Loverde Biophysical Journal 120 (3), 139a, 2021 | | 2021 |
Coarse-grained molecular dynamics simulation of supramolecular anticancer nanotubes A Manandhar, M Kang, S Loverde ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |
Interaction of supramolecular anticancer nanotubes with model cell membranes A Manandhar, M Kang, K Chakraborty, S Loverde ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |
Molecular modeling of peptide-drug amphiphiles M Kang, A Manandhar, P Tang, S Loverde ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |
Molecular Dynamics Simulations of Supramolecular Assemblies in Biology and Bionanotechnology A Manandhar | | 2019 |
Effect of nucleotide state and salt concentration on the protofilament conformation of tubulin octamers A Manandhar, M Kang, K Chakraborty, S Loverde ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
Coarse-grained molecular dynamics studies of the structure and stability of peptide-drug amphiphile filaments M Kang, A Manandhar, H Cui, S Loverde ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 254, 2017 | | 2017 |
Counterion interactions in supramolecular self-assembly S Belh, A Manandhar, G Huffman, K Ng, A Chowdhury, M Patel, N Yehya, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 252, 2016 | | 2016 |
Normal mode analysis of alpha-beta tubulin dimers A Manandhar, M Kang, S Loverde ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |