Current Lab Members
Postdoctoral Associates
PhD: University of California, Davis (with Dean Tantillo)
Zhitao’s research interests lie in utilizing ab initio MD simulations to develop new chemical reactivity models for ground-state and excited-state reactions, and applying ML to solve chemistry problems
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PhD: University of Texas at San Antonio (with Oleg Larionov)
Graduate Students
Undergraduate: NISER-Bhubaneswar, B.S Chemistry
Masters: NISER-Bhubaneswar, M.S Chemistry
Abhijeet’s interest lies in the development of computational tools and machine learning models to investigate chemical and biochemical phenomena from a quantum chemical perspective.
Allegheny College BS in Chemistry (minors in computer science and psychology)
LinkedIn ResearchGateDevelop computational tools and methods to advance the field of organic chemistry.
Undergraduate: Indian Institute of Science, B.S Chemistry
Masters: Indian Institute of Science, M.S Chemistry
Niket’s interest lie in using electronic structure methods to develop mechanistic models for a wide range of synthetic chemical problems.
Undergraduate: Salisbury University, B.S. in Chemistry and Biology. B.A. in Psychology.
EmailBrandon’s research interests lie in utilizing quantum mechanics and machine learning approaches to answer a myriad of chemical questions ranging from structure to reactivity.
Visiting Scholar
Undergraduate Students
Alumni Lab Members
Name | Role in the lab | Where are they now? |
---|---|---|
Fiona Richards | Undergraduate Student | |
Greta Coyner | Undergraduate Student | |
Santeri Aikonen | Postdoctoral Associate | Janssen Pharmaceuticals, Spring House, PA |
Juanvi Alegre Requena | Postdoctoral Associate | Juan de la Cierva Fellow, University of Zaragoza |
Turki Alturaifi | Undergraduate Student | PhD student at University of Pittsburgh |
Ruchuta Ardkhean | Graduate Student | Lecturer, HRH Princess Chulabhorn College of Medical Science, Thailand |
David Ascough | Graduate Student | Emerald Cloud Labs, San Francisco |
Alexandre Brethomé | Graduate Student | Infineum Fuels |
Wilian Cortopassi | Graduate Student | Novartis, San Francisco |
Louis de Lescure | Graduate Student | Sanofi, Boston |
Fernanda Duarte | Postdoctoral Associate | Associate Professor, University of Oxford |
Kate Fieseler | Undergraduate Student | DPhil Student at University of Oxford |
Liliana Gallegos | Graduate Student | Postdoc, Carnegie Mellon University (with Gabe Gomes & Olexander Isayev) |
Yanfei Guan | Postdoctoral Associate | Pfizer, Connecticut |
Sami Jaffar | Graduate Student | Navigant , London |
Kelvin Jackson | Graduate Student | Prytania Solutions, London |
Heidi Klem | Graduate Student | NRC Post-Doc at National Institute of Standards and Technology (NIST) |
Kiran Kumar | Graduate Student | Johnson & Johnson, Philadelphia |
Yingzi Li | Postdoctoral Associate | Postdoc, ICIQ, Spain (with Maseras) |
Jaehwan Lim | Graduate Student | |
Guilian Luchini | Graduate Student | BMS, San Diego |
Sreenithya Avadakkam | Postdoctoral Associate | Post Doc at TU Delft |
Kim Nguyen | Undergraduate Student | |
Nhu Nguyen | Postdoctoral Associate | Entos AI, San Diego |
Ricardo Liberato Peña | Graduate Student | Farmer Group, CSU |
Qian Peng | Postdoctoral Associate | Professor, Nankai University |
Simion Robert | Graduate Student | CTO, Enzbond, Oxford |
Trey Roupp | Undergraduate Student | |
Shree Sowndarya S V | Graduate Student | Bristol Myers Squibb, Princeton |
Jacqueline Tan | Graduate Student | Scientist at Institute of High Performance Computing (A*STAR) |
Bencan Tang | Postdoctoral Associate | Associate Professor, University of Nottingham, Ningbo |
Wojtek Treyde | Visiting Scholar | D.Phil. student, University of Oxford |
Hua Yuan | Visiting Scholar | Professor, Hunan University of Science and Technology |
Xinglong Zhang | Graduate Student | Assistant Professor, Chinese University of Hong Kong (CUHK) |