| A glycan gate controls opening of the SARS-CoV-2 spike protein T Sztain, SH Ahn, AT Bogetti, L Casalino, JA Goldsmith, E Seitz, ... Nature chemistry 13 (10), 963-968, 2021 | 322 | 2021 |
| AI-driven multiscale simulations illuminate mechanisms of SARS-CoV-2 spike dynamics L Casalino, AC Dommer, Z Gaieb, EP Barros, T Sztain, SH Ahn, A Trifan, ... The International Journal of High Performance Computing Applications 35 (5 …, 2021 | 169 | 2021 |
| # COVIDisAirborne: AI-enabled multiscale computational microscopy of delta SARS-CoV-2 in a respiratory aerosol A Dommer, L Casalino, F Kearns, M Rosenfeld, N Wauer, SH Ahn, ... The international journal of high performance computing applications 37 (1 …, 2023 | 77 | 2023 |
| Elucidation of cryptic and allosteric pockets within the SARS-CoV-2 main protease T Sztain, R Amaro, JA McCammon Journal of chemical information and modeling 61 (7), 3495-3501, 2021 | 65 | 2021 |
| Triptolide inhibits Wnt signaling in NSCLC through upregulation of multiple Wnt inhibitory factors via epigenetic modifications to Histone H3 I Nardi, T Reno, X Yun, T Sztain, J Wang, H Dai, L Zheng, B Shen, J Kim, ... International journal of cancer 143 (10), 2470-2478, 2018 | 37 | 2018 |
| Elucidation of transient protein-protein interactions within carrier protein-dependent biosynthesis TG Bartholow, T Sztain, A Patel, DJ Lee, MA Young, R Abagyan, ... Communications biology 4 (1), 340, 2021 | 26 | 2021 |
| Decoding allosteric regulation by the acyl carrier protein T Sztain, TG Bartholow, DJ Lee, L Casalino, A Mitchell, MA Young, ... Proceedings of the National Academy of Sciences 118 (16), e2025597118, 2021 | 24 | 2021 |
| Modifying the thioester linkage affects the structure of the acyl carrier protein T Sztain, A Patel, DJ Lee, TD Davis, JA McCammon, MD Burkart Angewandte Chemie International Edition 58 (32), 10888-10892, 2019 | 21 | 2019 |
| Isolation of PCR quality microbial community DNA from heavily contaminated environments M Gunawardana, S Chang, A Jimenez, D Holland-Moritz, ... Journal of Microbiological Methods 102, 1-7, 2014 | 17 | 2014 |
| Shifting the hydrolysis equilibrium of substrate loaded acyl carrier proteins T Sztain, TG Bartholow, JA McCammon, MD Burkart Biochemistry 58 (34), 3557-3560, 2019 | 10 | 2019 |
| A glycan gate controls opening of the SARS-CoV-2 spike protein. Nat Chem 13: 963–968 T Sztain, SH Ahn, AT Bogetti, L Casalino, JA Goldsmith, E Seitz, ... | 9 | 2021 |
| Protein–protein interaction based substrate control in the E. coli octanoic acid transferase, LipB TG Bartholow, T Sztain, MA Young, TD Davis, R Abagyan, MD Burkart RSC Chemical Biology 2 (5), 1466-1473, 2021 | 5 | 2021 |
| Control of Unsaturation in De Novo Fatty Acid Biosynthesis by FabA TG Bartholow, T Sztain, MA Young, DJ Lee, TD Davis, R Abagyan, ... Biochemistry 61 (7), 608-615, 2022 | 2 | 2022 |
| SARS-CoV-2 glycosylated spike activation mechanism-simulations of the full unbiased pathway T Sztain-Pedone, SH Ahn, A Bogetti, L Casalino, Z Gaieb, JA McCammon, ... Biophysical Journal 120 (3), 276a, 2021 | 1 | 2021 |
| Epigenetics in doxorubicin and docetaxel-resistant triple negative breast cancer T Sztain, H Chang Cancer Research 76 (14_Supplement), 4461-4461, 2016 | 1 | 2016 |
| 241 A Glycan Gate Controls Opening of the SARS-CoV-2 Spike Protein T Sztain, SH Ahn, AT Bogetti, L Casalino, JA Goldsmith, E Seitz, ... Novel Developments in Cryo-EM of Biological Molecules: Resolution in Time …, 0 | 1 | |
| Computer-aided biosynthetic pathway engineering T Sztain-Pedone Biophysical Journal 123 (3), 349a, 2024 | | 2024 |
| Adaptation to high pressure; insights from the genome of an evolved Escherichia coli strain with increased piezotolerance MN Allemann, S Ma, T Sztain, TGG Bartholow, IPG Marshall, ... bioRxiv, 2024.09. 24.613341, 2024 | | 2024 |
| Machine Learning Driven Simulations of SARS-CoV-2 Fitness Landscape AEP Durumeric, J Koehler, K Elez, L Raich, PA Suriana, T Sztain bioRxiv, 2024.09. 20.614179, 2024 | | 2024 |
| Interface Engineering of Carrier-Protein-Dependent Metabolic Pathways T Sztain, JC Corpuz, TG Bartholow, JO Sanlley Hernandez, Z Jiang, ... ACS Chemical Biology 18 (9), 2014-2022, 2023 | | 2023 |
