DEVELOPMENT OF ORGANOCATALYTIC REACTIONS FOR THE ASSEMBLY OF COMPLEX MOLECULES

Development of efficient organocatalytic reactions for the facile assembly of synthetically and medicinally useful molecules is an important task in modern organic synthesis. Towards this end, my Ph. D. study focuses on the development of novel organocatalytic reactions for the construction of structurally diverse molecular architectures. A chiral bifunctional amine thiourea as promoter has been developed as an efficient solution to a long standing challenging issue in atropo-enantioselective transesterification of the Bringmann lactones. This organocatalytic approach delivers the first highly enantioselective, high yielding dynamic kinetic resolution process for the preparation of axially chiral biaryl compounds with a broad substrate scope under mild reaction conditions. The higher reaction efficiency attributes to a distinct synergistic activation by bifunctional amine and thiourea groups from previous reported methods relying on mono activation. The new reactivity of N, O-acetals in an aminocatalytic fashion is harnessed for organic synthesis. Unlike widely used strategies requiring the use of acids and/or elevated temperatures, direct replacement of the amine component of the N, O-acetals by carbon-centered nucleophiles for C-C bond formation is realized under mild reaction conditions. Furthermore, without preformation of the N, O-acetals, amine catalyzed in situ formations of N, O-acetals are developed. Coupling both reactions into one-pot operation enables to achieve a catalytic process. We demonstrate the employment of simple anilines as promoters for the cyclization-substitution cascade reactions. The process offers an alternative approach to structurally diverse, ‘privileged’ 2-substituted 2H-chromenes, 1,3-dihydroisobenzofurans and isochromans. The synthetic power of the new process is furthermore shown by its application in the synthesis of natural products and biologically active molecules. Finally, a chiral amine/Lewis acid synergistically catalyzed cyclization-Michael cascade reaction has also been developed for the construction of chiral γ,γ-disubstituted butenolides. More significantly, the binary catalytic system promoted cyclization-Michael-aldol cascade reactions is also applied for the synthesis of (-)-aromdendranediol. The merits of this strategy are not only the employment of simple and cost-effective starting materials but also the enhancement of yields by the synergistic catalysis effect

Learning "Look-Ahead" Nonlocal Traffic Dynamics in a Ring Road

The macroscopic traffic flow model is widely used for traffic control and management. To incorporate drivers' anticipative behaviors and to remove impractical speed discontinuity inherent in the classic Lighthill-Whitham-Richards (LWR) traffic model, nonlocal partial differential equation (PDE) models with ``look-ahead" dynamics have been proposed, which assume that the speed is a function of weighted downstream traffic density. However, it lacks data validation on two important questions: whether there exist nonlocal dynamics, and how the length and weight of the ``look-ahead" window affect the spatial temporal propagation of traffic densities. In this paper, we adopt traffic trajectory data from a ring-road experiment and design a physics-informed neural network to learn the fundamental diagram and look-ahead kernel that best fit the data, and reinvent a data-enhanced nonlocal LWR model via minimizing the loss function combining the data discrepancy and the nonlocal model discrepancy. Results show that the learned nonlocal LWR yields a more accurate prediction of traffic wave propagation in three different scenarios: stop-and-go oscillations, congested, and free traffic. We first demonstrate the existence of ``look-ahead" effect with real traffic data. The optimal nonlocal kernel is found out to take a length of around 35 to 50 meters, and the kernel weight within 5 meters accounts for the majority of the nonlocal effect. Our results also underscore the importance of choosing a priori physics in machine learning models

Robust Safety for Mixed-Autonomy Traffic with Delays and Disturbances

Various control strategies and field experiments have been designed for connected and automated vehicles (CAVs) to stabilize mixed traffic that contains both CAVs and Human-driven Vehicles (HVs). The effect of these stabilizing CAV control strategies on traffic safety is still under investigation. In an effort to prioritize safety over stability, a safety-critical filter via control barrier functions (CBFs) can be designed by modifying the stabilizing nominal control input in a minimal fashion and imparting collision-free driving behaviors for CAVs and HVs. However, such formal safety guarantees can be violated if there are delays in the actuation and communication channels of the CAV. Considering both actuator and sensor delays, and disturbances, we propose robust safety-critical traffic control (RSTC) design to ensure ``robust safety'' of the mixed traffic. While predictor-based CBF has been developed to compensate for the actuator delay, uncertain speed disturbances from the head vehicle cause prediction error and require novel robust CBF design. Besides, safety-critical control with sensor delay also remains an open question. In RSTC, a state predictor with bounded error is designed, and robust CBF constraints are constructed to guarantee safety under actuator delay and disturbances. When there is a sensor delay, a state observer is designed and integrated with a predictor-based CBF to ensure robust safety. Numerical simulations demonstrate that the proposed RSTC avoids rear-end collisions for two unsafe traffic scenarios in the presence of actuator, sensor delays and disturbances

Towards Principled Task Grouping for Multi-Task Learning

This paper presents a novel approach to task grouping in Multitask Learning (MTL), advancing beyond existing methods by addressing key theoretical and practical limitations. Unlike prior studies, our approach offers a more theoretically grounded method that does not rely on restrictive assumptions for constructing transfer gains. We also propose a flexible mathematical programming formulation which can accommodate a wide spectrum of resource constraints, thus enhancing its versatility. Experimental results across diverse domains, including computer vision datasets, combinatorial optimization benchmarks and time series tasks, demonstrate the superiority of our method over extensive baselines, validating its effectiveness and general applicability in MTL

Safety-Critical Traffic Control by Connected Automated Vehicles

Connected automated vehicles (CAVs) have shown great potential in improving traffic throughput and stability. Although various longitudinal control strategies have been developed for CAVs to achieve string stability in mixed-autonomy traffic systems, the potential impact of these controllers on safety has not yet been fully addressed. This paper proposes safety-critical traffic control (STC) by CAVs -- a strategy that allows a CAV to stabilize the traffic behind it, while maintaining safety relative to both the preceding vehicle and the following connected human-driven vehicles (HDVs). Specifically, we utilize control barrier functions (CBFs) to impart collision-free behavior with formal safety guarantees to the closed-loop system. The safety of both the CAV and HDVs is incorporated into the framework through a quadratic program-based controller, that minimizes deviation from a nominal stabilizing traffic controller subject to CBF-based safety constraints. Considering that some state information of the following HDVs may be unavailable to the CAV, we employ state observer-based CBFs for STC. Finally, we conduct extensive numerical simulations -- that include vehicle trajectories from real data -- to demonstrate the efficacy of the proposed approach in achieving string stable and, at the same time, provably safe traffic

A Unified Encoder-Decoder Framework with Entity Memory

Entities, as important carriers of real-world knowledge, play a key role in many NLP tasks. We focus on incorporating entity knowledge into an encoder-decoder framework for informative text generation. Existing approaches tried to index, retrieve, and read external documents as evidence, but they suffered from a large computational overhead. In this work, we propose an encoder-decoder framework with an entity memory, namely EDMem. The entity knowledge is stored in the memory as latent representations, and the memory is pre-trained on Wikipedia along with encoder-decoder parameters. To precisely generate entity names, we design three decoding methods to constrain entity generation by linking entities in the memory. EDMem is a unified framework that can be used on various entity-intensive question answering and generation tasks. Extensive experimental results show that EDMem outperforms both memory-based auto-encoder models and non-memory encoder-decoder models.Comment: Accepted by the 2022 Conference on Empirical Methods in Natural Language Processing (EMNLP 2022

Composite learning adaptive backstepping control using neural networks with compact supports

© 2019 John Wiley & Sons, Ltd. The ability to learn is crucial for neural network (NN) control as it is able to enhance the overall stability and robustness of control systems. In this study, a composite learning control strategy is proposed for a class of strict-feedback nonlinear systems with mismatched uncertainties, where raised-cosine radial basis function NNs with compact supports are applied to approximate system uncertainties. Both online historical data and instantaneous data are utilized to update NN weights. Practical exponential stability of the closed-loop system is established under a weak excitation condition termed interval excitation. The proposed approach ensures fast parameter convergence, implying an exact estimation of plant uncertainties, without the trajectory of NN inputs being recurrent and the time derivation of plant states. The raised-cosine radial basis function NNs applied not only reduces computational cost but also facilitates the exact determination of a subregressor activated along any trajectory of NN inputs so that the interval excitation condition is verifiable. Numerical results have verified validity and superiority of the proposed approach