scholarly journals High‐Efficiency Non‐Fullerene Acceptors Developed by Machine Learning and Quantum Chemistry

2022 ◽  
pp. 2104742
Author(s):  
Qi Zhang ◽  
Yu Jie Zheng ◽  
Wenbo Sun ◽  
Zeping Ou ◽  
Omololu Odunmbaku ◽  
...  
2021 ◽  
Vol 1 (1) ◽  
pp. 24-26
Author(s):  
Jiarui Yang ◽  
Wen-Hao Li ◽  
Dingsheng Wang

2021 ◽  
Author(s):  
Hayley Weir ◽  
Keiran Thompson ◽  
Amelia Woodward ◽  
Benjamin Choi ◽  
Augustin Braun ◽  
...  

Inputting molecules into chemistry software, such as quantum chemistry packages, currently requires domain expertise, expensive software and/or cumbersome procedures. Leveraging recent breakthroughs in machine learning, we develop ChemPix: an offline,...


2021 ◽  
Vol 12 (1) ◽  
Author(s):  
Tanglong Yuan ◽  
Nana Yan ◽  
Tianyi Fei ◽  
Jitan Zheng ◽  
Juan Meng ◽  
...  

AbstractEfficient and precise base editors (BEs) for C-to-G transversion are highly desirable. However, the sequence context affecting editing outcome largely remains unclear. Here we report engineered C-to-G BEs of high efficiency and fidelity, with the sequence context predictable via machine-learning methods. By changing the species origin and relative position of uracil-DNA glycosylase and deaminase, together with codon optimization, we obtain optimized C-to-G BEs (OPTI-CGBEs) for efficient C-to-G transversion. The motif preference of OPTI-CGBEs for editing 100 endogenous sites is determined in HEK293T cells. Using a sgRNA library comprising 41,388 sequences, we develop a deep-learning model that accurately predicts the OPTI-CGBE editing outcome for targeted sites with specific sequence context. These OPTI-CGBEs are further shown to be capable of efficient base editing in mouse embryos for generating Tyr-edited offspring. Thus, these engineered CGBEs are useful for efficient and precise base editing, with outcome predictable based on sequence context of targeted sites.


Author(s):  
Wenchan Jiang ◽  
Ming Yang ◽  
Ying Xie ◽  
Zhigang Li

High efficiency video coding (HEVC) has been deemed as the newest video coding standard of the ITU-T Video Coding Experts Group and the ISO/IEC Moving Picture Experts Group. In this research project, in compliance with H.265 standard, the authors focused on improving the performance of encode/decode by optimizing the partition of prediction block in coding unit with the help of supervised machine learning. The authors used Keras library as the main tool to implement the experiments. Key parameters were tuned for the model in the convolution neuron network. The coding tree unit mode decision time produced in the model was compared with that produced in the reference software for HEVC, and it was proven to have improved significantly. The intra-picture prediction mode decision was also investigated with modified model and yielded satisfactory results.


2015 ◽  
Vol 11 (5) ◽  
pp. 2087-2096 ◽  
Author(s):  
Raghunathan Ramakrishnan ◽  
Pavlo O. Dral ◽  
Matthias Rupp ◽  
O. Anatole von Lilienfeld

TEM Journal ◽  
2021 ◽  
pp. 384-391
Author(s):  
Mustafa Ababneh ◽  
Aayat Aljarrah ◽  
Damla Karagozlu ◽  
Fezile Ozdamli

Machine learning is considered the most significant technique that processes and analyses educational big data. In this research paper, many previous papers related to analysing the educational big data that uses a lot of artificial intelligence techniques were studied. The purpose of the study is to identify weaknesses and gaps in previous researches. The results showed that many researches highlighted early expectations for academic performance. Unfortunately, no one thought of finding an effective way to guide high schooled students to reach their appropriate majors that can be suitable to their abilities. Those students need to be guided to pass this sensitive phase with high efficiency and good results. Thus, this school level is considered as the starting point for students’ academic lives, professional, and future success.


Sensors ◽  
2020 ◽  
Vol 20 (2) ◽  
pp. 333 ◽  
Author(s):  
Hsien-I Lin ◽  
Zhangguo Yu ◽  
Yi-Chen Huang

Sports robots have become a popular research topic in recent years. For table-tennis robots, ball tracking and trajectory prediction are the most important technologies. Several methods were developed in previous research efforts, and they can be divided into two categories: physical models and machine learning. The former use algorithms that consider gravity, air resistance, the Magnus effect, and elastic collision. However, estimating these external forces require high sampling frequencies that can only be achieved with high-efficiency imaging equipment. This study thus employed machine learning to learn the flight trajectories of ping-pong balls, which consist of two parabolic trajectories: one beginning at the serving point and ending at the landing point on the table, and the other beginning at the landing point and ending at the striking point of the robot. We established two artificial neural networks to learn these two trajectories. We conducted a simulation experiment using 200 real-world trajectories as training data. The mean errors of the proposed dual-network method and a single-network model were 39.6 mm and 42.9 mm, respectively. The results indicate that the prediction performance of the proposed dual-network method is better than that of the single-network approach. We also used the physical model to generate 330 trajectories for training and the simulation test results show that the trained model achieved a success rate of 97% out of 30 attempts, which was higher than the success rate of 70% obtained by the physical model. A physical experiment presented a mean error and standard deviation of 36.6 mm and 18.8 mm, respectively. The results also show that even without the time stamps, the proposed method maintains its prediction performance with the additional advantages of 15% fewer parameters in the overall network and 54% shorter training time.


2020 ◽  
Vol 500 (1) ◽  
pp. 388-396
Author(s):  
Tian Z Hu ◽  
Yong Zhang ◽  
Xiang Q Cui ◽  
Qing Y Zhang ◽  
Ye P Li ◽  
...  

ABSTRACT In astronomy, the demand for high-resolution imaging and high-efficiency observation requires telescopes that are maintained at peak performance. To improve telescope performance, it is useful to conduct real-time monitoring of the telescope status and detailed recordings of the operational data of the telescope. In this paper, we provide a method based on machine learning to monitor the telescope performance in real-time. First, we use picture features and the random forest algorithm to select normal pictures captured by the acquisition camera or science camera. Next, we cut out the source image of the picture and use convolutional neural networks to recognize star shapes. Finally, we monitor the telescope performance based on the relationship between the source image shape and telescope performance. Through this method, we achieve high-performance real-time monitoring with the Large Sky Area Multi-Object Fibre Spectroscopic Telescope, including guiding system performance, focal surface defocus, submirror performance, and active optics system performance. The ultimate performance detection accuracy can reach up to 96.7 per cent.


2020 ◽  
Vol 124 (47) ◽  
pp. 9854-9866
Author(s):  
Gabriel A. Pinheiro ◽  
Johnatan Mucelini ◽  
Marinalva D. Soares ◽  
Ronaldo C. Prati ◽  
Juarez L. F. Da Silva ◽  
...  

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