Current Members

last updated: 30/11/2023

Prof. Edina Rosta

Principal Investigator
Email - e.rosta@ucl.ac.uk

Dr. Dénes Berta

Postdoc
Email - d.berta@ucl.ac.uk
Topics - QM/MM, QM, ligand design

Dr. Bálint Dudás

Postdoc
Email - b.dudas@ucl.ac.uk
Topics - MD, ligand design

Dr. Tiejun Wei

Postdoc
Email - tirjun.wei@ucl.ac.uk
Topics - enhanced sampling, ML

Sebastian Berger

PhD student
Email - sebastian.berger@ucl.ac.uk
Topics - pKa calculation, QM, ML

Harry Lewin

PhD student
Email - harry.lewin.23@ucl.ac.uk
Topics - MD, QM/MM

Madhav Sharma

Research Assistant
Email - madhav.sharma.17@ucl.ac.uk

Previous Members (not a complete list)

Postdocs

Dr. Zsuzsanna Koczor-Benda
Dr. Sascha Gehrke
Dr. Tamás Földes
Dr. Francois Sicard
Dr. István Szabó
Dr. Silvia Gomez-Coca
Dr. Reynier Suardiaz
Dr. Pablo G. Jambrina

PhD students

Vladimir Koskin
Pedro Juan Buigues Jorro
Daniel Groom
Fahim Faizi
Magd Badaoui
Adam Kells
Teodora Mateeva
Sam Martino

Research Assistants

Daniel Felfoldi