Learned dynamical models can accurately predict trajectories while producing unreliable sensitivities when differentiated or transposed, limiting their use in inverse problems and scientific decision-making. Classical adjoints provide exact local derivatives, but a single adjoint cannot represent the nonlinear response of a system to a family of finite-amplitude perturbations. We introduce SALTO (Solver-Anchored Lifted Transfer Operators), a Koopman-based framework for inferring finite-amplitude sources. In the lifted space, the nonlinear dynamics are approximated by a linear propagator, and its transpose carries each sensor backward in a single solve. The result is a reusable lifted adjoint that predicts the measurement produced by any candidate localized event with one encoder pass and an inner product. To give the model the simulator's exact local behavior, SALTO imposes three structural constraints: it anchors the physical-state dynamics to the simulator's linearized propagator, centers the learned observables so that they vanish to second order at the reference state, and uses a block-triangular lifted propagator. These constraints guarantee that the model reduces to the simulator's tangent dynamics and classical adjoint as the amplitude vanishes, while the learned observables carry only the finite-amplitude correction. On three nonlinear PDE systems, SALTO predicts the measurements of finite-amplitude sources to within 2-8% where the classical adjoint is in error by 41-165%, recovers source position and intensity from sparse sensors nearly as accurately as inversion through the solver, and samples the joint posterior of two interacting sources, matching the solver's posterior on reaction-diffusion at a twentieth of its cost. One trained model serves new sensor layouts and measurement times with a single backward solve.
This paper investigates developing real-world perception for active agents, proposes Gibson Environment for this purpose, and showcases a set of perceptual tasks learned therein.
F. Xia, Amir Zamir, Zhi-Yang He et al.· 2018 IEEE/CVF Conference on...· 1,069 citations· ⚡112
The results indicate that software engineering work practices are chosen opportunistically, adapted and configured to provide value under the constrains imposed by the startup context.
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The possibility of inferring high-dimensional data inference in a model that consists of a prior and an auxiliary differentiable constraint given some additional information is considered, thereby allowing a range of potential applications in adapting models to new domains and tasks.
Alexandros Graikos, Esmeralda S. Whitammer, N. Jojic et al.· Neural Information Processin...· 316 citations· ⚡15
It is proved that any global minimizer of the trajectory balance objective can define a policy that samples exactly from the target distribution, and empirically demonstrate the benefits of the trajectories balance objective for GFlowNet convergence, diversity of generated samples, and robustness to long action sequenc...
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An algorithm is proposed which leverages disentangled semantic factors to generate adversarial perturbation by altering controlled semantic attributes to fool the learner towards various "adversarial" targets.
Haonan Qiu, Chaowei Xiao, Lei Yang et al.· arXiv.org· 208 citations· ⚡17
This work proposes a HALO that directly maximizes the utility of generations instead of maximizing the log-likelihood of preferences, and suggests that the best loss depends on the inductive biases most appropriate for a given setting, an oft-overlooked consideration.
A machine-learning approach called CheMeleon provides a practical way to develop new drugs or other molecules with much less detailed, expensive experimentation.
Research Manager Mike Walker reflects on a career spanning hacker culture, cybersecurity, and AI, sharing lessons about trust, teamwork, leadership, and why solving difficult problems requires curiosity, judgment, agility—and an understanding of the rules. The post Learn the rules: The hacker mindset appeared first on Microsoft Research.
Learn how Google Antigravity and our Cheminformatics Skills accelerate drug discovery workflows, search compounds, and propose novel rigidified macrocycles.
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