> Sharing Resource < A comprehensive new study from MIT and Accenture researchers examines when quantum computers will actually disrupt computational chemistry—and the results might surprise you. "Quantum Advantage in Computational Chemistry?" by Hans Gundlach, Keeper Sharkey, Jayson Lynch, Victoria Hazoglou, Kung-Chuan Hsu, Carl Dukatz, Eleanor Crane, Karin Walczyk, Marcin Bodziak, Johannes Galatsanos-Dueck, Neil Thompson The Reality Check: Despite decades of hype about quantum computing revolutionizing chemistry, classical methods will likely remain superior for most applications through at least the next 20 years. The 10^13 speed disadvantage quantum computers face today is substantial. The Sweet Spot: Quantum computers will be most impactful for highly accurate computations with smaller molecules, while classical computers will continue dominating large-scale molecular simulations. Abstract: For decades, computational chemistry has been posited as one of the areas in which quantum computing would revolutionize. However, the algorithmic advantages that fault-tolerant quantum computers have for chemistry can be overwhelmed by other disadvantages, such as error correction, processor speed, etc. To assess when quantum computing will be disruptive to computational chemistry, we compare a wide range of classical methods to quantum computational methods by extending the framework proposed by Choi, Moses, and Thompson. Our approach accounts for the characteristics of classical and quantum algorithms, and hardware, both today and as they improve. We find that in many cases, classical computational chemistry methods will likely remain superior to quantum algorithms for at least the next couple of decades. Nevertheless, quantum computers are likely to make important contributions in two important areas. First, for simulations with tens or hundreds of atoms, highly accurate methods such as Full Configuration Interaction are likely to be surpassed by quantum phase estimation in the coming decade. Secondly, in cases where quantum phase estimation is most efficient less accurate methods like Couple Cluster and Moller-Plesset, could be surpassed in fifteen to twenty years if the technical advancements for quantum computers are favorable. Overall, we find that in the next decade or so, quantum computing will be most impactful for highly accurate computations with small to medium-sized molecules, whereas classical computers will likely remain the typical choice for calculations of larger molecules. Link: https://lnkd.in/evW7zHbe #QuantumComputing #ComputationalChemistry #DrugDiscovery #Innovation #TechTrends
Comparing Quantum and Classical Methods for Complex Simulations
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Summary
Comparing quantum and classical methods for complex simulations means evaluating how quantum computers, which use unique principles of physics, stack up against traditional computers in modeling challenging systems. While quantum computing can solve certain specialized problems dramatically faster, classical methods remain the mainstream choice for most large-scale and practical simulations, especially in fields like chemistry and engineering.
- Assess simulation needs: Identify whether your problem requires highly accurate, small-scale modeling or broader, large-scale computations to determine which technology is more suitable.
- Monitor emerging breakthroughs: Stay informed about recent quantum algorithms and advances that could shift the balance for simulating intricate systems in physics, chemistry, or AI.
- Explore hybrid solutions: Consider combining quantum and classical approaches for targeted tasks, such as sampling rare events or improving machine learning in environments where classical methods struggle.
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Everybody’s asking about the 𝗸𝗶𝗹𝗹𝗲𝗿 𝗮𝗽𝗽 𝗳𝗼𝗿 𝗾𝘂𝗮𝗻𝘁𝘂𝗺 𝗰𝗼𝗺𝗽𝘂𝘁𝗲𝗿𝘀. But when a team actually uses one to explore 𝗳𝘂𝗻𝗱𝗮𝗺𝗲𝗻𝘁𝗮𝗹 𝗽𝗵𝘆𝘀𝗶𝗰𝘀 in a way we couldn't before, the 𝘀𝗶𝗹𝗲𝗻𝗰𝗲 from the broader community is deafening. Really? I’ve talked about using quantum computers for exploring physics before. I get it - 𝗶𝘁'𝘀 𝗻𝗼𝘁 𝘁𝗵𝗲 𝗶𝗺𝗺𝗲𝗱𝗶𝗮𝘁𝗲, 𝗱𝗶𝘀𝗿𝘂𝗽𝘁𝗶𝘃𝗲 𝗮𝗽𝗽𝗹𝗶𝗰𝗮𝘁𝗶𝗼𝗻 𝘁𝗵𝗮𝘁 𝗩𝗖𝘀 𝗮𝗻𝗱 𝗺𝗮𝗿𝗸𝗲𝘁 𝗮𝗻𝗮𝗹𝘆𝘀𝘁𝘀 𝘄𝗮𝗻𝘁 𝘁𝗼 𝗵𝗲𝗮𝗿 𝗮𝗯𝗼𝘂𝘁. 𝗕𝘂𝘁 𝗜 𝗳𝗶𝗻𝗱 𝗶𝘁 𝗮𝗯𝘀𝗼𝗹𝘂𝘁𝗲𝗹𝘆 𝗮𝗺𝗮𝘇𝗶𝗻𝗴 𝘁𝗵𝗮𝘁 𝘄𝗲'𝗿𝗲 𝗳𝗶𝗻𝗮𝗹𝗹𝘆 𝗯𝘂𝗶𝗹𝗱𝗶𝗻𝗴 𝘁𝗼𝗼𝗹𝘀 𝘁𝗵𝗮𝘁 𝗮𝗹𝗹𝗼𝘄 𝘂𝘀 𝘁𝗼 𝘂𝗻𝗱𝗲𝗿𝘀𝘁𝗮𝗻𝗱 𝗼𝘂𝗿 𝘄𝗼𝗿𝗹𝗱 𝗼𝗻𝗲 𝗹𝗮𝘆𝗲𝗿 𝗱𝗲𝗲𝗽𝗲𝗿. A new paper from Google 𝗤𝘂𝗮𝗻𝘁𝘂𝗺 𝗔𝗜 & 𝗰𝗼𝗹𝗹𝗮𝗯𝗼𝗿𝗮𝘁𝗼𝗿𝘀, is a perfect case in point. The team tackled a monster of a problem in condensed matter physics: 𝗵𝗼𝘄 𝘁𝗼 𝘀𝗶𝗺𝘂𝗹𝗮𝘁𝗲 𝘀𝘆𝘀𝘁𝗲𝗺𝘀 𝘄𝗶𝘁𝗵 𝗱𝗶𝘀𝗼𝗿𝗱𝗲𝗿. Classically, this is a brute-force nightmare: You have to simulate thousands or even millions of different disorder configurations one by one, which can take an exponential amount of time. 𝗜𝗻𝘀𝘁𝗲𝗮𝗱 𝗼𝗳 𝘀𝗶𝗺𝘂𝗹𝗮𝘁𝗶𝗻𝗴 𝗼𝗻𝗲 𝗰𝗼𝗻𝗳𝗶𝗴𝘂𝗿𝗮𝘁𝗶𝗼𝗻 𝗮𝘁 𝗮 𝘁𝗶𝗺𝗲, 𝗚𝗼𝗼𝗴𝗹𝗲 𝘂𝘀𝗲𝗱 𝘁𝗵𝗲𝗶𝗿 𝟴𝟭-𝗾𝘂𝗯𝗶𝘁 𝗾𝘂𝗮𝗻𝘁𝘂𝗺 𝗽𝗿𝗼𝗰𝗲𝘀𝘀𝗼𝗿 𝘁𝗼 𝗽𝗿𝗲𝗽𝗮𝗿𝗲 𝗮 𝘀𝘁𝗮𝘁𝗲 𝘁𝗵𝗮𝘁 𝗶𝘀 𝗮 𝘀𝘂𝗽𝗲𝗿𝗽𝗼𝘀𝗶𝘁𝗶𝗼𝗻 𝗼𝗳 𝗮𝗹𝗹 𝗽𝗼𝘀𝘀𝗶𝗯𝗹𝗲 𝗱𝗶𝘀𝗼𝗿𝗱𝗲𝗿 𝗰𝗼𝗻𝗳𝗶𝗴𝘂𝗿𝗮𝘁𝗶𝗼𝗻𝘀. Then they gave it a tiny kick of energy in one spot, and watched what happened. The result? The energy stayed put. It refused to spread. This is a phenomenon called 𝗗𝗶𝘀𝗼𝗿𝗱𝗲𝗿-𝗙𝗿𝗲𝗲 𝗟𝗼𝗰𝗮𝗹𝗶𝘇𝗮𝘁𝗶𝗼𝗻 (𝗗𝗙𝗟). Even though the system's evolution and the initial state were perfectly uniform and disorder-free, the underlying superposition over different "backgrounds" caused the system to localize. 𝗜𝘁’𝘀 𝗮 𝘀𝘁𝘂𝗻𝗻𝗶𝗻𝗴 𝗱𝗲𝗺𝗼𝗻𝘀𝘁𝗿𝗮𝘁𝗶𝗼𝗻 𝗼𝗳 𝗾𝘂𝗮𝗻𝘁𝘂𝗺 𝗺𝗲𝗰𝗵𝗮𝗻𝗶𝗰𝘀 𝗮𝘁 𝘄𝗼𝗿𝗸 𝗼𝗻 𝗮 𝘀𝗰𝗮𝗹𝗲 𝘁𝗵𝗮𝘁’𝘀 𝗶𝗻𝗰𝗿𝗲𝗱𝗶𝗯𝗹𝘆 𝗱𝗶𝗳𝗳𝗶𝗰𝘂𝗹𝘁 𝗳𝗼𝗿 𝗰𝗹𝗮𝘀𝘀𝗶𝗰𝗮𝗹 𝗰𝗼𝗺𝗽𝘂𝘁𝗲𝗿𝘀 𝘁𝗼 𝗵𝗮𝗻𝗱𝗹𝗲, 𝗲𝘀𝗽𝗲𝗰𝗶𝗮𝗹𝗹𝘆 𝗶𝗻 𝟮𝗗. But this isn't just a cool physics experiment. This work carves out a concrete path to quantum advantage. The team proposed an 𝗮𝗹𝗴𝗼𝗿𝗶𝘁𝗵𝗺 based on this technique that offers a 𝗽𝗼𝗹𝘆𝗻𝗼𝗺𝗶𝗮𝗹 𝘀𝗽𝗲𝗲𝗱𝘂𝗽 𝗳𝗼𝗿 𝘀𝗮𝗺𝗽𝗹𝗶𝗻𝗴 𝗱𝗶𝘀𝗼𝗿𝗱𝗲𝗿𝗲𝗱 𝘀𝘆𝘀𝘁𝗲𝗺𝘀. So yes, let's keep working toward fault-tolerant machines that can break RSA and optimize your portfolio. But let's not ignore the incredible science happening right now. 📸 Credits: Google 𝗤𝘂𝗮𝗻𝘁𝘂𝗺 𝗔𝗜 & 𝗖𝗼𝗹𝗹𝗮𝗯𝗼𝗿𝗮𝘁𝗼𝗿𝘀 (arXiv:2410.06557) Pedram Roushan
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The Schrödinger Equation Gets Practical: Quantum Algorithm Speeds Up Real-World Simulations Quantum computing has taken a major leap forward with a new algorithm designed to simulate coupled harmonic oscillators, systems that model everything from molecular vibrations to bridges and neural networks. By reformulating the dynamics of these oscillators into the Schrödinger equation and applying Hamiltonian simulation methods, researchers have shown that complex physical systems can be simulated exponentially faster on a quantum computer than with traditional algorithms. This breakthrough demonstrates not only a practical use of the Schrödinger equation but also the deep connection between quantum dynamics and classical mechanics. The study introduces two powerful quantum algorithms that reduce the required resources to only about log(N) qubits for N oscillators, compared to the massive computational demands of classical methods. This exponential speedup could transform fields such as engineering, chemistry, neuroscience, and material science, where coupled oscillators serve as the backbone of real-world modeling. By bridging theory and application, this research underscores how quantum computing is redefining problem-solving in physics and beyond. With proven exponential advantages and the ability to simulate systems once thought computationally impossible, this quantum algorithm marks a milestone in quantum simulation, Hamiltonian dynamics, and real-world physics applications. The findings point toward a future where quantum computers can accelerate scientific discovery, optimize engineering designs, and even open new frontiers in AI and computational neuroscience. #QuantumComputing #SchrodingerEquation #HamiltonianSimulation #QuantumAlgorithm #CoupledOscillators #QuantumPhysics #ComputationalScience #Neuroscience #Chemistry #Engineering
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𝗤𝘂𝗮𝗻𝘁𝘂𝗺 𝗣𝗿𝗼𝗯𝗮𝗯𝗶𝗹𝗶𝘁𝘆 × 𝗟𝗟𝗠 𝗜𝗻𝘁𝗲𝗹𝗹𝗶𝗴𝗲𝗻𝗰𝗲 𝖰𝗎𝖺𝗇𝗍𝗎𝗆 𝖺𝗆𝗉𝗅𝗂𝗍𝗎𝖽𝖾𝗌 𝗋𝖾𝖿𝗂𝗇𝖾 𝗅𝖺𝗇𝗀𝗎𝖺𝗀𝖾 𝗉𝗋𝖾𝖽𝗂𝖼𝗍𝗂𝗈𝗇 𝖯𝗁𝖺𝗌𝖾 𝖺𝗅𝗂𝗀𝗇𝗆𝖾𝗇𝗍 𝖾𝗇𝗋𝗂𝖼𝗁𝖾𝗌 𝖼𝗈𝗇𝗍𝖾𝗑𝗍𝗎𝖺𝗅 𝗇𝗎𝖺𝗇𝖼𝖾 Classical probability treats token likelihoods as isolated scalars, but quantum computation reimagines them as amplitude vectors whose phases encode latent context. By mapping transformer outputs onto Hilbert spaces, we unlock interference patterns that selectively amplify coherent meanings while cancelling noise, yielding sharper posteriors with fewer samples. Variational quantum circuits further permit gradient‑based training of unitary operators, allowing language models to entangle distant dependencies without the quadratic memory overhead of classical self‑attention. The result is not simply faster or smaller models, but a fundamentally richer probabilistic grammar where superposition captures ambiguity and measurement collapses it into actionable insight. As qubit counts rise and error rates fall, the convergence of quantum linear algebra and deep semantics promises a new era in which language understanding is limited less by data volume than by our willingness to rethink probability itself. #quantum #ai #llm
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Is Quantum Machine Learning (QML) Closer Than We Think? Select areas within quantum computing are beginning to shift from long-term aspiration to practical impact. One of the most promising developments is Quantum Machine Learning, where early pilots are uncovering advantages that classical systems are unable to match. 🔷 The Quantum Advantage: Quantum computers operate on qubits, which can represent multiple states simultaneously. This enables them to process complex, interdependent variables at a scale and speed that classical machines cannot. While current hardware still faces limitations, consistent progress in simulation and optimization is confirming the technology’s potential. 🔷 Why QML Matters: QML combines quantum circuits with classical models to unlock performance improvements in targeted, data-intensive domains. Early-stage experimentation is already showing promise: • Accelerated training for complex models • More effective handling of high-dimensional and sparse datasets • Greater accuracy with smaller sample sizes 🔷 The Timeline Is Shortening: Quantum systems are inherently probabilistic, aligning well with generative AI and modeling under uncertainty. Just as classical computing advanced despite hardware imperfections, current-generation quantum systems are producing measurable results in narrow but high-value use cases. As these outcomes become more consistent, enterprise adoption will follow. 🔷 What Enterprises Can Do Today: Quantum hardware does not need to be perfect for companies to begin exploring value. Practical entry points include: • Simulating rare or complex risk scenarios in finance and operations • Using quantum inspired sampling for better forecasting and sensitivity analysis • Generating synthetic datasets in regulated or data scarce environments • Targeting challenges where classical AI struggles, such as subtle anomalies or low signal environments • Exploring use cases in fraud detection, claims forecasting, patient risk stratification, drug efficacy modeling, and portfolio optimization 🔷 Final Thought: Quantum Machine Learning is no longer confined to research. It is becoming a tool with real strategic potential. Organizations that begin investing in awareness, experimentation, and talent today will be better positioned to lead as the ecosystem matures. #QuantumMachineLearning #QuantumComputing #AI
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⚛️ Quantum Computing – Strategic Recommendations for the Industry 📜 This whitepaper surveys the current landscape and short- to mid-term prospects for quantum-enabled optimization and machine learning use cases in industrial settings. Grounded in the QCHALLenge program, it synthesizes hardware trajectories from different quantum architectures and providers, and assesses their maturity and potential for real-world use cases under a standardized traffic-light evaluation framework. We provide a concise summary of relevant hardware roadmaps, distinguishing superconducting and ion-trap technologies, their current states, modalities, and projected scaling trajectories. The core of the presented work are the use case evaluations in the domains of optimization problems and machine learning applications. For the conducted experiments, we apply a consistent set of evaluation criteria (model formulation, scalability, solution quality, runtime, and transferability) which are assessed in a shared system of three categories, ranging from optimistic (solutions produced by quantum computers are competitive with classical methods and/or a clear path to a quantum advantage is shown) to pessimistic (significant hurdles prevent practical application of quantum solutions now and potentially in the future). The resulting verdicts illuminate where quantum approaches currently offer promise, where hybrid classical-quantum strategies are most viable, and where classical methods are expected to remain superior. ℹ️ Erdman et al - 2026
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The study "Benchmarking MedMNIST Dataset on Real Quantum Hardware" presents several important outcomes. This research provides an interesting approach using quantum hardware for inference. Key outcomes of this study: * The QML workflow that the researchers propose first involves classical preprocessing of medical images followed by training device-aware quantum circuits on classical hardware using noiseless simulators. The best-performing trained models are then transpiled and run on IBM quantum hardware with error suppression and mitigation techniques. Finally, the results from the quantum hardware are classically post-processed to obtain the classification labels. * The experimental results on several MedMNIST datasets (PneumoniaMNIST, BreastMNIST, OCTMNIST, RetinaMNIST, DermaMNIST, BloodMNIST, PathMNIST, and OrganSMNIST) establish an interesting benchmark. * The study found that even with a reduced feature set compared to classical methods, the QML models achieved promising classification accuracy and AUC scores on real quantum hardware for various MedMNIST datasets. For instance, the QML model achieved an accuracy of 85.4% and an AUC of 82.2% on the 2-class PneumoniaMNIST dataset after applying error suppression and mitigation. * A comparison with classical machine learning (ML) benchmarks provided in the MedMNIST dataset documentation showed that while the QML results do not consistently outperform the best classical models (which use full-resolution images), they represent a significant step for QML given the hardware limitations and reduced input features. Notably, the QML model's accuracy on PneumoniaMNIST matched that of some classical ResNet models. * A further comparative analysis by training classical ML baselines (ResNet-18 and ResNet-50) using the same reduced 8x8 input features as the QML model on the 5-class RetinaMNIST dataset demonstrated a potential quantum benefit. The QML model outperformed both ResNet architectures in terms of classification accuracy and AUC, despite having significantly fewer trainable parameters, suggesting advantages in both performance and computational complexity in this specific comparison. Overall, this study demonstrates the feasibility and potential of using purely quantum models on current noisy quantum hardware for medical image classification, setting a benchmark and highlighting the impact of device-aware circuit design and error mitigation techniques. Here the article: https://lnkd.in/dsrCGaqq Here the GitHub repo: https://lnkd.in/dqYTwXqF #quantum #qml #datascience #machinelearning
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We’ve all known #Moderna for some years for their role in transforming mRNA science to rapidly develop life-saving vaccines and therapeutics. But what you might not know is that behind almost every mRNA innovation lies an incredibly hard problem: figuring out how each sequence folds. Each mRNA strand can twist and loop into an astronomical number of secondary structures. Only a handful of those make sense, given the physical laws governing molecular behavior. Predicting which ones are biologically plausible? That involves solving a complex combinatorial optimization problem, which turns out to be a sweet spot for quantum computing… exactly where pure classic approaches hit a wall. So the team began creating and testing quantum novel algorithms -like CVaR VQE- and benchmarking them against classical solvers to predict mRNA folding. And the results? The Quantum-enabled pipeline is already matching classic solvers and is expected to augment beyond what’s at reach of classic computers today. ‼️ You can read all details here: https://lnkd.in/ex5gxDCn. You will learn about: 🔹 A 𝐧𝐞𝐚𝐫-𝐭𝐞𝐫𝐦 𝐪𝐮𝐚𝐧𝐭𝐮𝐦-𝐞𝐧𝐚𝐛𝐥𝐞𝐝 𝐛𝐢𝐨𝐭𝐞𝐜𝐡𝐧𝐨𝐥𝐨𝐠𝐲 𝐩𝐢𝐩𝐞𝐥𝐢𝐧𝐞 🔹 Massive 𝐥𝐚𝐫𝐠𝐞 𝐬𝐜𝐚𝐥𝐞: last year, we ran the largest variational quantum algorithm yet -80 qubits modeling 60-nucleotide mRNA strands (and targeting this year 156 qubits and 950-gate circuits) 🔹A 𝐜𝐥𝐞𝐯𝐞𝐫 𝐚𝐥𝐠𝐨𝐫𝐢𝐭𝐡𝐦𝐢𝐜 𝐛𝐨𝐨𝐬𝐭: adding a Conditional Value at Risk (CVaR) lightweight classical post-processing step, to reduce the sensitivity to noisy outliers. 🔹 𝐑𝐞𝐜𝐨𝐫𝐝-𝐦𝐚𝐭𝐜𝐡𝐢𝐧𝐠 𝐩𝐞𝐫𝐟𝐨𝐫𝐦𝐚𝐧𝐜𝐞: the quantum-enhanced simulations are now reaching the same quality as top classical solvers and aiming at going beyond, proving what a powerful platform Quantum Computing is for Science. To me, this case study perfectly shows 2 vectors we are fully committed at IBM: 1. 𝐐𝐮𝐚𝐧𝐭𝐮𝐦-𝐜𝐥𝐚𝐬𝐬𝐢𝐜 𝐰𝐨𝐫𝐤𝐟𝐥𝐨𝐰𝐬: the future of computing is going to be full of these hybrid approaches aiming at combining the most efficient use of quantum and classical resources in a 𝐣𝐨𝐢𝐧𝐭 𝐪𝐮𝐚𝐧𝐭𝐮𝐦 𝐡𝐢𝐠𝐡-𝐩𝐞𝐫𝐟𝐨𝐫𝐦𝐚𝐧𝐜𝐞 𝐜𝐨𝐦𝐩𝐮𝐭𝐢𝐧𝐠 (𝐇𝐏𝐂) 𝐞𝐧𝐯𝐢𝐫𝐨𝐧𝐦𝐞𝐧𝐭. 2. 𝐀𝐥𝐠𝐨𝐫𝐢𝐭𝐡𝐦𝐢𝐜 𝐢𝐧𝐧𝐨𝐯𝐚𝐭𝐢𝐨𝐧: when you represent your problem in mathematical terms, abstracting from the domain, it is much easier to borrow ideas from other domains and boost innovation (probably you know that CVaR or Conditional Value at Risk comes from finance). IBM IBM Research IBM Quantum #innovationthatmatters #Science #FutureOfComputing
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I get at least two inbound pings every month from life-sciences companies asking some version of the same question: “So what can #quantumcomputing actually do for drug discovery and pharmaceuticals?” These used to be cocktail-napkin conversations. Now they sound more like budget discussions. What’s changed isn’t the curiosity—it’s the intent. The tone has shifted from fiction to spreadsheet. These are no longer blue-sky debates about some distant quantum future. The focus is on near-term, hybrid quantum-classical use cases that can deliver measurable advantage well before fault-tolerant quantum machines arrive. Over lunch during JPM with our resident quantum whisperer and Global Quantum leader for healthcare and life sciences at IBM Research , Gopal Karemore, PhD, I got the clearest framing yet: quantum computing today is roughly where AI was a decade ago—promising, awkward, and not quite ready to replace classical HPC. Pharma leaders don’t see it as a substitute for today’s supercomputers; they see it as a future-defining capability for molecular science. Right now, the real value is in learning, experimentation, and building hybrid workflows that blend quantum with classical simulation—especially for molecular problems where classical methods rely on approximations like DFT and force fields that eventually hit physical limits. Gopal and team came back from JPM with a consistent message from pharma and biotech: #quantum is viewed as a long-term R&D accelerator, not a near-term cost-cutting tool. The smartest organizations are running targeted pilots, building internal quantum literacy, and partnering with technology providers to become “quantum-ready.” The goal isn’t speed for its own sake—it’s better science: improved decision-making, reduced uncertainty, and new chemical and biological insight when quantum complements AI and classical simulation. So far, the use cases cluster into three main buckets: -->Molecular and electronic structure simulation – improving the accuracy of binding energies and reaction mechanisms. -->Drug discovery optimization – particularly hit-to-lead and lead optimization. -->Protein structure and dynamics – longer term, to better understand folding and functional conformations. The metrics are refreshingly practical: prediction accuracy, fewer experimental cycles, and faster (and cheaper) advancement of candidates. The hoped-for outcome is equally old-fashioned: higher-quality leads, lower attrition, and better R&D productivity. In other words, #quantum isn’t here to fire your chemists. It’s here to give them fewer wrong answers—eventually. Thank you Gopal and was lovely catching up with you and Shervin Ayati. #quantumcomputing #quantum #drugdiscovery
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Quantum Algorithm Advances Search for Local Minima in Many-Body Systems Physicists and engineers have long sought to harness quantum computing for problems that are exceptionally challenging for classical computers. One such problem is determining the ground state, or lowest energy state, of quantum many-body systems, which consist of multiple interacting quantum particles. Finding this state is crucial for understanding material properties, but traditional computational methods often struggle with the complexity of these systems. Researchers from the California Institute of Technology and the AWS Center for Quantum Computing have demonstrated that while classical computers find it difficult to identify local minima—energy states lower than their immediate surroundings but not necessarily the lowest possible—quantum computers can excel at this task. Their newly developed quantum algorithm, published in Nature Physics, efficiently simulates how a system evolves toward its ground state, leveraging quantum mechanics to bypass obstacles that trap classical methods. This breakthrough highlights quantum computing’s potential in solving fundamental physics problems more effectively than classical approaches. By accelerating the search for stable energy states, this algorithm could aid in designing new materials, optimizing chemical reactions, and advancing our understanding of quantum systems in ways that were previously unattainable.
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