Abstract

The current global health emergency in the form of the Coronavirus 2019 (COVID-19) pandemic has 16 highlighted the need for fast, accurate, and efficient drug discovery pipelines. Traditional drug 17 discovery projects relying on in vitro high-throughput screening (HTS) involve large investments and 18 sophisticated experimental set-ups, affordable only to big biopharmaceutical companies. In this 19 scenario, application of efficient state-of-the-art computational methods and modern artificial 20 intelligence (AI)-based algorithms for rapid screening of repurposable chemical space [approved drugs 21 and natural products (NPs) with proven pharmacokinetic profiles] to identify the initial leads is a 22 powerful option to save resources and time. Structure-based drug repurposing is a popular in silico 23 repurposing approach. In this review, we discuss traditional and modern AI-based computational 24 methods and tools applied at various stages for structure-based drug discovery (SBDD) pipelines. 25 Additionally, we highlight the role of generative m

Abstract

Typically, automatic syllable stress detection is posed as a supervised classification problem, for which, a classifier is trained using manually annotated (existing) syllable data and stress labels. However, in real testing scenarios, syllable data is estimated since manual annotation is not possible. Further, the estimation process could result in a mismatch between the lengths of the estimated and the existing syllable data causing no one- to-one correspondence between the estimated syllable data and the existing labels. Hence, the existing labels and estimated syllable data together cannot be used to train the classifier. This can be avoided by manually labeling the estimated syllable data, which, however, is impractical. In contrast, we, in this work, propose a method to obtain labels for estimated syllable data without using manual annotation. The proposed method considers a weighted version of the well-known Wagner–Fisher algorithm (WFA) to assign the existing labels to the estimated syllable data, where the weights are computed based on a set of three constraints defined in the proposed algorithm. Experiments on ISLE corpus show that the performance obtained on the test set for four different types of estimated syllable data are higher when the assigned labels and estimated syllable data are used for training compared to those when existing labels and existing syllable data are used. Also, the label assignment accuracy using the proposed method is found to be higher than that using a baseline scheme based on WFA.

Abstract

This article proposes Convolutional Neural Network based Auto Encoder (CNN-AE) to predict location dependent rate and coverage probability of a network from its topology. We train the CNN utilising BS location data of India, Brazil, Germany and the USA and compare its performance with stochastic geometry (SG) based analytical models. In comparison to the best-fitted SG- based model, CNN-AE improves the coverage and rate prediction errors by a margin of as large as 40% and 25% respectively. As an application, we propose a low complexity, provably convergent algorithm that, using trained CNN-AE, can compute locations of new BSs that need to be deployed in a network in order to satisfy pre-defined spatially heterogeneous performance goals.

Abstract

A method of calibrating cameras used to collect images to form an omni-stereo image is disclosed. The method may comprise determining intrinsic and extrinsic camera param eters for each of a plurality of left eye cameras and right eye cameras arranged along a viewing circle or ellipse and angled tangentially with respect to the viewing circle or ellipse; categorizing left-right pairs of the plurality of left eye cameras and the plurality of right eye cameras into at least a first category, a second category or a third category; aligning the left-right pairs of cameras that fall into the first category; aligning the left-right pairs of cameras that fall into the second category; and aligning the left-right pairs of cameras that fall into the third category by using extrinsic parameters of the left-right pairs that fall into the first category, and of the left-right pairs that fall into the second category.

Abstract

Building a quantum secure internet is one of the most important challenges in the field of quantum technologies [1,2]. It would ensure worldwide information-theoretically secure communication. The idea of quantum repeaters [3–5] gives hope that this dream will come true. However, the level of quantum security proposed originally in a seminal article by Bennett and Brassard [6] seems to be insufficient due to the fact that on the way between an honest manufacturer and an honest user, an active hacker can change with the inner workings of a quantum device, making it totally insecure [7]. Indeed, the hardware Trojan-horse attacks on random number generators are known [8], and the active hacking on quantum devices became a standard testing approach since the seminal attack by Makarov [9]. The idea of device-independent (DI) security overcomes this obstacle [7,10] (see also [11] and references therein). Although difficult to be done in practice, it has been demonstrated quite recently in several recent experiments [12–14]. In parallel, the study of the limitations of this approach in terms of upper bounds on the distillable key has been put forward [15–18]. However, these approaches focus on pointto-point quantum device-independent secure communication. In this paper we introduce the upper bounds on the performance of the device-independent conference key agreement (DI-CKA) [19,20]. The task of the conference agreement is to distribute to N > 2 honest parties the same secure key for one-time-pad encryption. A protocol achieving this task in a device-independent manner has been shown in Ref. [20]. We set an upper bound on the performance of such protocols in a network setting. We focus on physical behaviors with N users (for arbitrary N > 2), where each user is both the sender and receiver of the behavior treated as a black box. This situation is a special case of a network describable with a multiplex quantum channel where inputs and outputs are classical with quantum phenomena going inside the physical behavior [21]. All N trusted parties have the role of both the sender to and receiver from the channel and their goal is to obtain a secret key in a device-independent way against a quantum adversary. Aiming at upper bounds on the device-independent key, we narrow the consideration to the independent and identically distributed case. In this scenario, the honest parties share n identical devices. All the N parties set (classical) inputs x = (x1,..., xN ) to each of the n shared devices P(a|x) and receive (classical) outputs a = (a1,..., aN ) from each of them. We restrict our consideration to quantum devices. Such devices are realized by certain measurements M ≡ ⊗N i=1Mxi ai on quantum states ρA1,...,AN ≡ ρN(A). We define these devices (ρN(A),M) = Tr[ρN(A) ⊗N i=1 Mxi ai ]. In this work we provide upper bounds on the deviceindependent conference key distillation rates for arbitrary multipartite states. As the first main result, we introduce a multipartite generalization of the cc-squashed entanglement provided in Ref. [22] and developed in Ref. [18]. With a little abuse of notation with respect to that used in Refs. [16,18], for the sake of the reader, we will omit the fact that the measure is multipartite as well as reduce the abbreviation cc in its name and here call it just reduced c-squashed entanglement,

Abstract

The time delay between signals received at two spatially separated microphones is estimated using the location of the peak in the cross-correlation sequence between the two signals. The estimated delay is usually expressed in integer multiple of the sampling interval. The robustness of the delay estimation is affected by the degradation of the signals due to waveform distortion, noise, reflections, and reverberation. The broadband nature of speech signals is exploited to derive multiple evidence for the time delay from each frequency component of the signal. This helps to reduce the effects of waveform distortion, as the cross-correlation is computed on individual components. The multiple evidence provides robustness in the estimation of the time delay. The accuracy of the estimated time delay depends on the error between the integer delay and the true fractional delay. Methods are proposed to estimate the fractional part of the sampling interval of the delay. Robustness of the proposed method of estimation of the fractional part of the delay is examined for different types and levels of additive noise, as well for reverberation. Experimental results are given for data collected in an actual live room

Abstract

XAlign: Cross-lingual Fact-to-Text Alignment and Generation for Low-Resource Languages Tushar Abhishek, Shivprasad Sagare, Bhavyajeet Singh, Anubhav Sharma, Manish Gupta∗ and Vasudeva Varma Information Retrieval and Extraction Lab, IIIT Hyderabad, India {tushar.abhishek,shivprasad.sagare,bhavyajeet.singh,anubhav.sharma}@research.iiit.ac.in, {manish.gupta,vv}@iiit.ac.in Abstract Multiple critical scenarios (like Wikipedia text generation given English Infoboxes) need au- tomated generation of descriptive text in low resource (LR) languages from English fact triples. Previous work has focused on English fact-to-text (F2T) generation. To the best of our knowledge, there has been no previous at- tempt on cross-lingual alignment or generation for LR languages. Building an effective cross- lingual F2T (XF2T) system requires alignment between English structured facts and LR sen- tences. We propose two unsupervised meth- ods for cross-lingual alignment. We contribute XALIGN, an XF2T dataset with 0.45M pairs across 8 languages, of which 5402 pairs have been manually annotated. We also train strong baseline XF2T generation models on XAlign dataset

Abstract

We consider the problem of achieving fair classification in Federated Learning (FL) under data heterogeneity. Most of the approaches pro- posed for fair classification require diverse data that represent the different demographic groups involved. In contrast, it is common for each client to own data that represents only a single demographic group. Hence the existing approaches cannot be adopted for fair classification models at the client level. To resolve this challenge, we propose several aggregation techniques. We empirically validate these techniques by comparing the resulting fairness and accuracy on CelebA and UTK datasets

Abstract

We consider a budgeted combinatorial multi-armed bandit setting where, in every round, the algorithm selects a super-arm consisting of one or more arms. The goal is to minimize the total expected regret after all rounds within a limited budget. Existing techniques in this literature either fix the budget per round or fix the number of arms pulled in each round. Our setting is more general where based on the remaining budget and remaining number of rounds, the algorithm can decide how many arms to be pulled in each round. First, we propose CBwK-Greedy-UCB algorithm, which uses a greedy technique, CBwK-Greedy, to allocate the arms to the rounds. Next, we propose a reduction of this problem to Bandits with Knapsacks (BwK) with a single pull. With this reduction, we propose CBwK-LP-UCB that uses PrimalDualBwK ingeniously. We rigorously prove regret bounds for CBwK-LP-UCB. We experimentally compare the two algorithms and observe that CBwK-Greedy- UCB performs incrementally better than CBwK-LP-UCB. We also show that for very high budgets, the regret goes to zero.

Abstract

We introduce MUGL, a novel deep neural model for large-scale, diverse generation of single and multi-person pose-based action sequences with locomotion. Our con- trollable approach enables variable-length generations cus- tomizable by action category, across more than 100 cate- gories. To enable intra/inter-category diversity, we model the latent generative space using a Conditional Gaussian Mixture Variational Autoencoder. To enable realistic gen- eration of actions involving locomotion, we decouple local pose and global trajectory components of the action se- quence. We incorporate duration-aware feature represen- tations to enable variable-length sequence generation. We use a hybrid pose sequence representation with 3D pose sequences sourced from videos and 3D Kinect-based se- quences of NTU-RGBD-120. To enable principled com- parison of generation quality, we employ suitably modi- fied strong baselines during evaluation. Although smaller and simpler compared to baselines, MUGL provides better quality generations, paving the way for practical and con- trollable large-scale human action generation.