Next generation HPC/QC in silico drug discovery platform for de novo design

Project Information

ATLAS

Grant agreement ID: 190141418

DOI

10.3030/190141418

Project closed

EC signature date 28 July 2022

Start date 1 September 2022

End date 31 August 2024

Funded under

• The European Innovation Council (EIC)

Total cost

€ 4 249 375,00

EU contribution

€ 2 500 000,00

Coordinated by

QUBIT PHARMACEUTICALS
France

CORDIS provides links to public deliverables and publications of HORIZON projects.

Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Publications

Book chapters (1)

Polarizable multiscale dynamics for probing solvent and complex environments

Author(s): D. Loco ; J.-P. Piquemal
Published in: Photochemistry: Volume 50, ISBN 978-1-83916-567-2
Publisher: Royal Society of Chemistry
DOI: 10.1039/9781839167676

Peer reviewed articles (3)

QM/AMOEBA description of properties and dynamics of embedded molecules

Author(s): Michele Nottoli, Mattia Bondanza, Patrizia Mazzeo, Lorenzo Cupellini, Carles Curutchet, Daniele Loco, Louis Lagardère, Jean-Philip Piquemal, Benedetta Mennucci, Filippo Lipparini
Published in: Wire computational molecular science, ISSN 1759-0876
Publisher: WIREs Computational Molecular Science
DOI: 10.1002/WCMS.1674

Greedy Gradient-free Adaptive Variational Quantum Algorithms on a Noisy Intermediate Scale Quantum Computer

Author(s): César Feniou, Baptiste Claudon, Muhammad Hassan, Axel Courtat, Olivier Adjoua, Yvon Maday, Jean-Philip Piquemal
Published in: Greedy Gradient-free Adaptive Variational Quantum Algorithms on a Noisy Intermediate Scale Quantum Computer, ISSN 2331-8422
Publisher: arXiv
DOI: 10.48550/ARXIV.2306.17159

Overlap-ADAPT-VQE: Practical Quantum Chemistry on quantum Computers via Overlap-Guided Compact Ansatze

Author(s): César Feniou, Muhammad Hassan, Diata Traoré, Emmanuel Giner, Yvon Maday & Jean-Philip Piquemal
Published in: Communications Physics, ISSN 2399-3650
Publisher: Communications Physics
DOI: 10.1038/S42005-023-01312-Y

Intellectual Property Rights

Other (6)

Method for generating optimized ansatz with adaptive variational quantum algorithms on a noisy intermediate scale quantum computer for example for practical quantum chemistry, uses thereof and related computing systems

Application/Publication number: EP23 306077.1
Date: 2023-06-29
Applicant(s): QUBIT PHARMACEUTICALS

Computer implemented method for computing quantum-enhanced chemical properties of a chemical system

Application/Publication number: EP24 305780.9
Date: 2024-05-17
Applicant(s): QUBIT PHARMACEUTICALS

Methods and systems for polylogarithmic-depth controlled-NOT gate implementation in quantum circuits and computers

Application/Publication number: EP23 307297.4
Date: 2023-12-20
Applicant(s): QUBIT PHARMACEUTICALS

Methods and systems for adjustable-depth circuit ofr controlled-NOT gate implementation in quantum circuits and computers and controlled-NOT gate thereof

Application/Publication number: EP23 307298.2
Date: 2023-12-20
Applicant(s): QUBIT PHARMACEUTICALS

Method for generating overlap-guided compact ansatz for practical quantum chemistry, uses thereof and related computing systems

Application/Publication number: EP23 305081.4
Date: 2024-01-23
Applicant(s): QUBIT PHARMACEUTICALS

Approximating a density function based on a Gaussian mixture using aquantum computer

Application/Publication number: EP23 305613.4
Date: 2023-04-20
Applicant(s): QUBIT PHARMACEUTICALS

Trademark (1)

Trademark Qubit Pharmaceuticals

Application/Publication number: France- 23/5001274
Date: 2023-10-25
Applicant(s): QUBIT PHARMACEUTICALS