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Accelerating Novel Antibacterial Discovery

Quantum simulation and quantum machine learning solution to accelerate the antibacterial discovery and lower resistance.

OWNER

STATUS

Phase 1 – Outline

QUANTUM APPROACH

Machine Learning (Quantum Inspired)

SDGs

CONTRIBUTORS

Global Antibiotic Research & Development Partnership

McMaster University

Universita degli Studi di Cagliari

qBraid

ORIRGIN OF CONTRIIBUTORS

CONTEXT/IMPACT:

The WHO has identified antimicrobial resistance (AMR) as one of the top ten threats to global public health. The latest estimates are that in 2019, nearly 5 million deaths were associated with, and 1.3 million deaths attributable to drug-resistant bacterial infections. AMR has the potential to reverse decades of progress in fighting infectious diseases and undermine many aspects of modern medicine. If AMR is left unchecked, its annual death toll is expected to rise considerably, and according to estimates could cost as much as US$3.4 trillion to the global economy by 2030. Despite the urgent need to develop effective treatments for drug-resistant infections, most pharmaceutical companies have left the market to invest in more profitable areas, producing a “market failure” that has hugely exacerbated the AMR crisis. The greatest burden of AMR is in low- and middle-income countries with weaker healthcare systems and a greater lack of access to effective antibiotics.

 

HOW COULD QUANTUM HELP:

Our failure to discover new antibiotics largely stems from investigation of insufficient chemical space. The largest screens for antibiotics are only a few million molecules. This number is vanishingly small when compared to the theoretical number of drug-like molecules (~10 to the power of 60). Moreover, the molecules applied in these screening programs are limited in their structural diversity. An approach to address this involves the application of machine learning algorithms that can predict antibacterial activity in silico. Despite the novel generative AI algorithms to allow vast exploration of chemical space,, the challenge remains in broadening the exploration of chemical spaces. One alternative is to leverage innovative frameworks like quantum reservoir computing (QRC). QRC has the potential to explore a broader range of chemical and biological interactions more efficiently than classical methods while avoiding the difficulty in loading complex data on quantum computers.

2024 | Open Quantum Institute

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OQI Partners are institutions that benefit from peer recognition for their scientific contributions or impact expertise.

Requirements:

  1. Either have served as OQI’s spearheading partners during its incubation phase or have consistently engaged resources to OQI’s work as OQI members for at least a year
  2. Commit to co-shape the OQI’s unique value propositions for the three years of the pilot throughout the 4A’s​
  3. Are vetted by the OQI Advisory Committee
  4. Abide to OQI’s values and openness principles

OQI Members are institutions that benefit from peer recognition for their scientific contributions or their impact expertise.

Requirements:

  1. Have disclosed their governance structure
  2. Commit to actively contribute on at least one of the 4A’s assiduously for at least one year​
  3. Have appointed at least one expert from their institution as focal point of contact for OQI and contributor to its working groups
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  6. Qualify for partner level after having demonstrated their commitment for at least one year​

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Friends socialise the OQI to their communities.

Downloadable PDF version of Charter

 

Description:

The Open Quantum Institute (OQI) is a multilateral governance initiative that promotes global and inclusive access to quantum computing and the development of applications for the benefit of humanity. As a novel science diplomacy instrument, it brings together research, diplomacy, private sector and philanthropy stakeholders. OQI is hosted by CERN during its pilot phase (2024-2026).

 

Mission:

• Accelerating applications for humanity: Realising the full potential of quantum computing to have the widest possible societal impact by accelerating the development of use cases geared towards achieving the United Nations’ Sustainable Development Goals (SDGs) and succeeding framework , thanks to the combined forces of researchers, developers and entrepreneurs from academia and private sector as well as the United Nations, and large NGOs
• Access for all: Providing global, inclusive and equitable access to a pool of public and private quantum computers and simulators available via the cloud
• Advancing capacity building: Developing educational tools to enable everyone around the world to contribute to the development of quantum computing and make the most of the technology
• Activating multilateral governance for the SDGs: Providing a neutral forum to help shape multilateral governance of quantum computing for the SDGs

 

Values:

• Inclusivity, global scope
  • Enable people from all countries, regardless of whether they have any quantum computing capability of their own, to benefit from and to participate in the development of (i) quantum computing applications that address global challenges, in particular those that are closely related to their own specific challenges, and (ii) the multilateral governance of quantum computing for the SDGs
• Openness
  • Share experiences, knowledge, and methods for the benefit of all, following Open Science best practice
  • Make openly available the results – outcomes of joint activities related to the OQI mission conducted by the OQI community – to society via open repositories and/or through the use of open licences
• Focus on impact
  • Ensure that applications are developed for their quantum computing potential to tackle real-world problems that will benefit humanity
  • Consider and balance their ethical, legal, and societal implications
• Independence
  • Enable everyone to participate free from individual, national, corporate or any other agendas
  • Develop applications with a technology neutral approach.
• Collaboration
  • Foster a community of diverse expertise, backgrounds and geographies, enabled by international cooperation and diplomacy

 

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