| Decomposition Products of Phosphine Under Pressure: PH2 Stable and Superconducting? A Shamp, T Terpstra, T Bi, Z Falls, P Avery, E Zurek Journal of the American Chemical Society 138 (6), 1884-1892, 2016 | 123 | 2016 |
| Antiviral approaches against influenza virus R Kumari, SD Sharma, A Kumar, Z Ende, M Mishina, Y Wang, Z Falls, ... Clinical microbiology reviews 36 (1), e00040-22, 2023 | 86 | 2023 |
| Protein mimetic amyloid inhibitor potently abrogates cancer-associated mutant p53 aggregation and restores tumor suppressor function L Palanikumar, L Karpauskaite, M Al-Sayegh, I Chehade, M Alam, ... Nature communications 12 (1), 3962, 2021 | 85 | 2021 |
| The XtalOpt evolutionary algorithm for crystal structure prediction Z Falls, P Avery, X Wang, KP Hilleke, E Zurek The Journal of Physical Chemistry C 125 (3), 1601-1620, 2020 | 82 | 2020 |
| The Dynamic Equilibrium Between (AlOMe)n Cages and (AlOMe)n·(AlMe3)m Nanotubes in Methylaluminoxane (MAO): A First-Principles Investigation Z Falls, N Tyminska, E Zurek Macromolecules 47 (24), 8556-8569, 2014 | 54 | 2014 |
| A synthetic small molecule stalls pre-mRNA splicing by promoting an early-stage U2AF2-RNA complex R Chatrikhi, CF Feeney, MJ Pulvino, G Alachouzos, AJ MacRae, Z Falls, ... Cell chemical biology 28 (8), 1145-1157. e6, 2021 | 35 | 2021 |
| Evaluating the performance of drug-repurposing technologies J Schuler, Z Falls, W Mangione, ML Hudson, L Bruggemann, ... Drug discovery today 27 (1), 49-64, 2022 | 34 | 2022 |
| XtalOpt version r9: An open-source evolutionary algorithm for crystal structure prediction Z Falls, DC Lonie, P Avery, A Shamp, E Zurek Computer Physics Communications 199, 178-179, 2016 | 26 | 2016 |
| Shotgun drug repurposing biotechnology to tackle epidemics and pandemics W Mangione, Z Falls, T Melendy, G Chopra, R Samudrala Drug Discovery Today 25 (7), 1126, 2020 | 24 | 2020 |
| cando. py: Open source software for predictive bioanalytics of large scale drug–protein–disease data W Mangione, Z Falls, G Chopra, R Samudrala Journal of chemical information and modeling 60 (9), 4131-4136, 2020 | 22 | 2020 |
| Computational prediction and analysis of the 27 Al solid-state NMR spectrum of methylaluminoxane (MAO) at variable temperatures and field strengths Z Falls, E Zurek, J Autschbach Physical Chemistry Chemical Physics 18 (34), 24106-24118, 2016 | 21 | 2016 |
| Exploration of interaction scoring criteria in the CANDO platform Z Falls, W Mangione, J Schuler, R Samudrala BMC research notes 12, 1-6, 2019 | 20 | 2019 |
| Identifying protein features and pathways responsible for toxicity using machine learning and tox21: Implications for predictive toxicology L Moukheiber, W Mangione, M Moukheiber, S Maleki, Z Falls, M Gao, ... Molecules 27 (9), 3021, 2022 | 16 | 2022 |
| XtalOpt Version r10: An open–source evolutionary algorithm for crystal structure prediction P Avery, Z Falls, E Zurek Computer Physics Communications 217, 210-211, 2017 | 15 | 2017 |
| Determination of the structures of molecularly imprinted polymers and xerogels using an automated stochastic approach A Wach, J Chen, Z Falls, D Lonie, ER Mojica, D Aga, J Autschbach, ... Analytical chemistry 85 (18), 8577-8584, 2013 | 14 | 2013 |
| A deep-learning proteomic-scale approach for drug design B Overhoff, Z Falls, W Mangione, R Samudrala Pharmaceuticals 14 (12), 1277, 2021 | 11 | 2021 |
| XtalOpt version r11: an open-source evolutionary algorithm for crystal structure prediction P Avery, Z Falls, E Zurek Computer Physics Communications 222, 418-419, 2018 | 11 | 2018 |
| A fluorescence-based, gain-of-signal, live cell system to evaluate SARS-CoV-2 main protease inhibition R Dey-Rao, GR Smith, U Timilsina, Z Falls, R Samudrala, S Stavrou, ... Antiviral research 195, 105183, 2021 | 9 | 2021 |
| Proteomic network analysis of bronchoalveolar lavage fluid in ex-smokers to discover implicated protein targets and novel drug treatments for chronic obstructive pulmonary disease MJ Mammen, C Tu, MC Morris, S Richman, W Mangione, Z Falls, J Qu, ... Pharmaceuticals 15 (5), 566, 2022 | 8 | 2022 |
| Effective holistic characterization of small molecule effects using heterogeneous biological networks W Mangione, Z Falls, R Samudrala Frontiers in Pharmacology 14, 1113007, 2023 | 6 | 2023 |
Ram SamudralaProfessor and Chief, Division of Bioinformatics, University at BuffaloVerificeret mail på compbio.org
