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Machine learning-driven investigation of the structure and dynamics of the BMIM-BF4 room temperature ionic liquid

Faraday Discuss., 2024, 253,129-145
DOI: 10.1039/D4FD00025K, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Fabian Zills, Moritz René Schäfer, Samuel Tovey, Johannes Kästner, Christian Holm
We demonstrate a learning-on-the-fly procedure to train machine-learned potentials from single-point density functional theory calculations before performing production molecular dynamics simulations.
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Open Heritage : Community-Driven Adaptive Reuse in Europe: Best Practice [Electronic book] / ed. by Heike Oevermann, Levente Polyák, Hanna Szemzö, Harald A. Mieg.

Basel : Birkhäuser, [2023]




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Significant adsorption enhancements driven by pore microenvironment tuning for efficient C2H2/C2H4 separation in a chemically stable Ni7-cluster-based framework

Inorg. Chem. Front., 2024, Advance Article
DOI: 10.1039/D4QI01856G, Research Article
Yunli Wang, Rizhao Zhang, Jin-Peng Xue, Yuqiao Chai, Bao Li, Jia Li
This study presents a stable Ni7-cluster MOF with enhanced adsorption through pore microenvironment tuning. Two types of guest-free frameworks achieve C2H2/C2H4 separation, providing deep insights into separation mechanisms.
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Facet-engineered CeO2 with Cu single atom drives photocatalytic selective oxidation of 5-hydroxymethylfurfural

Inorg. Chem. Front., 2024, Accepted Manuscript
DOI: 10.1039/D4QI02230K, Research Article
Yifei Li, Senyao Meng, Ping Wang, Miao He, Jiasai Yao, Cheng Yang, Fangzhou Mo, Jiang Li, Zhenxing Li
The crystal facet of CeO2 is crucial in governing the catalytic performance. However, studies on the relationship between the photocatalytic oxidation performance of CeO2 and its crystal facets are scarce....
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Metal Node Exchange-Driven Ligand-Strain Modulation Strategy for One-Dimensional Crystalline Coordination Polymers

Inorg. Chem. Front., 2024, Accepted Manuscript
DOI: 10.1039/D4QI02422B, Research Article
Gengxin Wu, Yong-Kang Zhu, Dongxia Li, Jia-Rui Wu, Yan Wang, Zhiquan Zhang, Ying-Wei Yang
Engineering ideal functional coordination polymers (CPs) via post-synthetic modification has emerged as a powerful synthetic strategy to achieve desirable functionalities and superior properties. In this work, we report a versatile...
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Multifunctional flexible magnetic drive gripper for target manipulation in complex constrained environments

Lab Chip, 2024, 24,2122-2134
DOI: 10.1039/D3LC00945A, Paper
Meiying Zhao, Ye Tao, Wenshang Guo, Zhenyou Ge, Hanqing Hu, Ying Yan, Chaoxia Zou, Guiyu Wang, Yukun Ren
A multifunctional flexible magnetic drive gripper is synthetically designed to achieve active steering and carry out operations on different targets in a constrained environment by changing the external magnetic field.
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Fabrication of black TiO2 through microwave heating for visible light-driven photocatalytic degradation of rhodamine 6G

React. Chem. Eng., 2024, 9,3003-3015
DOI: 10.1039/D4RE00202D, Paper
Riska Rachmantyo, Afif Akmal Afkauni, Ricky Reinaldo, Lei Zhang, Arramel Arramel, Muhammad Danang Birowosuto, Arie Wibowo, Hermawan Judawisastra
This study shows that a narrower band gap TiO2, namely black TiO2, can be prepared using NaBH4 as a reducing material and microwave heating, which is a faster, greener, and simpler method than the existing method using furnace heating.
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Agent-based modeling of stress anisotropy driven nematic ordering in growing biofilms

Soft Matter, 2024, Advance Article
DOI: 10.1039/D3SM01535A, Paper
Open Access
Changhao Li, Japinder Nijjer, Luyi Feng, Qiuting Zhang, Jing Yan, Sulin Zhang
Our agent-based model reveals complex spatiotemperal evolution of the morphology and internal cell ordering of Vibrio cholerae biofilms.
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Topology of ferroelectric nematic droplets: the case driven by flexoelectricity or depolarization field

Soft Matter, 2024, Advance Article
DOI: 10.1039/D3SM01042B, Communication
Yu Zou, Jidan Yang, Xinxin Zhang, Mingjun Huang, Satoshi Aya
Emerging polar nematics exhibits nontrivial topologies in confinement, controlled by the magnitude of the polarization.
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Dynamics and phase behavior of metallo-dielectric rod-shaped microswimmers driven by Alternating Current electric field

Soft Matter, 2024, Accepted Manuscript
DOI: 10.1039/D4SM00206G, Paper
Suvendu Kumar Panda, Srikanta Debata, Nomaan Alam Kherani, Dhruv Pratap Singh
The ability to move and self-organize in response to external stimuli is a fascinating feature of living active matter. Here, the metallo-dielectric rod-shaped microswimmers are shown to have a similar...
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Resource limitation and population fluctuation drive spatiotemporal order in microbial communities

Soft Matter, 2024, Advance Article
DOI: 10.1039/D4SM00066H, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Rohit Khandoori, Kaustav Mondal, Pushpita Ghosh
Resource-driven dynamics in bacterial colonies. Insights into cell length regulation and spatial organization reveal the complex interplay between resources and microbial community dynamics.
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Optimizing methanol synthesis from CO2 using graphene-based heterogeneous photocatalyst under RSM and ANN-driven parametric optimization for achieving better suitability

RSC Adv., 2024, 14,12496-12512
DOI: 10.1039/D4RA00578C, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Ramesh Kumar, Jayato Nayak, Somnath Chowdhury, Sashikant Nayak, Shirsendu Banerjee, Bikram Basak, Masoom Raza Siddiqui, Moonis Ali Khan, Rishya Prava Chatterjee, Prashant Kumar Singh, WooJin Chung, Byong-Hun Jeon, Sankha Chakrabortty, Suraj K. Tripathy
Assessment of the performance of linear and nonlinear regression-based methods for estimating in situ catalytic CO2 transformations employing TiO2/Cu coupled with hydrogen exfoliation graphene (HEG) has been investigated.
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Meet Oinam, Imphal’s only woman commercial driver

Her life is a drive off the beaten track, and it has not been easy




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Green perspective drives the renaissance of anionic diene polymerization

Polym. Chem., 2024, 15,4297-4311
DOI: 10.1039/D4PY00805G, Review Article
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Moritz Rauschenbach, Moritz Meier-Merziger, Holger Frey
Polymers based on 1,3-diene monomers play a pivotal role in many commercial elastomers and thermoplastic elastomers. This review summarizes the state of the art and recent developments in the living anionic polymerization of dienes.
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Polymer chemistry informed neural networks (PCINNs) for data-driven modelling of polymerization processes

Polym. Chem., 2024, 15,4580-4590
DOI: 10.1039/D4PY00995A, Paper
Nicholas Ballard, Jon Larrañaga, Kiarash Farajzadehahary, José M. Asua
A method for training neural networks to predict the outcome of polymerization processes is described that incorporates fundamental chemical knowledge. This permits generation of data-driven predictive models with limited datasets.
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AI-driven precision subcellular navigation with fluorescent probes

J. Mater. Chem. B, 2024, 12,11054-11062
DOI: 10.1039/D4TB01835D, Review Article
Yingli Zhu, Yanpeng Fang, Wenzhi Huang, Weiheng Zhang, Fei Chen, Jie Dong, Wenbin Zeng
AI-driven precision subcellular navigation with fluorescent probes.
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An innovative electrohydrodynamics-driven SERS platform for molecular stratification and treatment monitoring of lung cancer

J. Mater. Chem. B, 2024, Advance Article
DOI: 10.1039/D4TB01434K, Highlight
Tuotuo Zhang, Biao Dong, Huiling Wang, Shuai Zhang
A schematic electrohydrodynamics-driven SERS platform to profile four proteins on sEVs to generate a unique molecular signature for lung cancer stratification.
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Nanozyme linked multi-array gas driven sensor for real-time quantitative detection of Group A streptococcus

Analyst, 2024, 149,5433-5442
DOI: 10.1039/D4AN00787E, Paper
Qi Wang, Pei Liu, Ke Xiao, Wenying Zhou, Jinfeng Li, Yun Xi
Group A streptococcus (GAS) is a pathogen typically transmitted through respiratory droplets and skin contact, causing an estimated 700 million mild non-invasive infections worldwide each year.
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Capillary-flow driven microfluidic sensor based on tyrosinase for fast user-friendly assessment of pesticide exposures

Analyst, 2024, Advance Article
DOI: 10.1039/D4AN01203H, Paper
Open Access
Claire E. Hefner, Prakash Aryal, Eric Brack, Todd Alexander, Charles S. Henry
Assessment of pesticide exposure using a fast-flow capillary device (created with Bio.Render.com).
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Structural Distortion Driven Polaronic Transport and Table-like Magnetocaloric Properties in Polycrystalline Tb0.7Sr0.3MnO3 compound

Phys. Chem. Chem. Phys., 2024, Accepted Manuscript
DOI: 10.1039/D4CP03760J, Paper
Dipak Mazumdar, I. Das, Kalipada Das
This research mainly explores the structural, magnetic, magneto-transport, and magnetocaloric properties of the polycrystalline Tb0.7Sr0.3MnO3 compound. The results reveal a significant modification of the compound’s ground state with increasing the...
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Bull runs, a Mercedes farewell tour, driver churn: Formula One storylines to keep an eye on

Racing fans will have to wait until next year to savour the tasty prospect of Lewis Hamilton turning out for Ferrari, but that doesn’t mean 2024 is merely the lull before the storm




drive

Sainz 'the cork in the bottle' in F1 driver market jigsaw




drive

INRC3 driver Premlal passes away




drive

Ferrari driver Carlos Sainz agrees on two-year deal to join Williams Formula 1 team

Ferrari driver Carlos Sainz has agreed on a two-year deal to join Formula One rival Williams




drive

Indian F2 driver Kush Maini survives scary crash in Baku, penalised post race

The rear of Maini's car was totally destroyed by the impact of the crash and fortunately, he came out of it unscathed




drive

Ruhaan, Veer and Aqil drive to victories

The second race was more eventful, in which Pariat collided with Alibhai.




drive

At the brand new Madras International Karting Arena, drive on the track that Mika Hakkinen, Narain Karthikeyan, and Karun Chandhok raced on

At the brand new Madras International Karting Arena, drive on the track that Mika Hakkinen, Narain Karthikeyan, and Karun Chandhok raced on The 1.2 kilometre track is India’s first karting circuit built to FIA-CIK (Commission Internationale de Karting) specifications



  • Life & Style

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Ajith Kumar announces his own racing team; Fabian Duffieux onboard as its official racing driver

The new team is set to participate in various international racing series, starting with the competitive 24H European series in the Porche 992 GT3 cup category




drive

Shortage of teachers drives govt. schools to hire local staff

Faculty, students pitch in with contributions to pay salary for new recruits




drive

Fostering the digital adoption drive in India

Why 8i Ventures backs startups that are digitising the economy




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Metal-free photocatalysts with charge-transfer excited states enable visible light-driven atom transfer radical polymerization

Chem. Commun., 2024, Accepted Manuscript
DOI: 10.1039/D4CC04470C, Communication
Yuchen Huang, Yangxin Liu, Yingde Yan, Yanjun Gong, Yifan Zhang, Yanke Che, Jincai Zhao
Photoredox-catalyzed atom transfer radical polymerization (O-ATRP) offers powerful tools for the precise control of polymer synthesis. Metal-free photocatalysts are particularly desirable due to their high level of control in O-ATRP...
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Elucidating the interplay between entropy-driven and patch-mediated bonding in directing nanoscale assemblies

Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D4ME00153B, Paper
Kireeti Akkunuri, Xiangyu Zhang, Thi Vo
The interplay between directional patchy attraction and shape-driven entropic forces sculpts the spatial and orientational orderings between anisotropic building blocks, giving rise to symmetry breaking of pre-programmed interactions between particles.
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A novel CuAl2O4/MoS2/BaFe12O19 magnetic photocatalyst simultaneously coupling type I and Z-scheme heterojunctions for the sunlight-driven removal of tetracycline hydrochloride

Environ. Sci.: Nano, 2024, Advance Article
DOI: 10.1039/D3EN00970J, Paper
Mengjun Han, Shifa Wang, Xinmiao Yu, Xianlun Yu, Huajing Gao, Xianju Zhou, Dengfeng Li, Leiming Fang, Jagadeesha Angadi V., Mohd Ubaidullah, Bidhan Pandit
A novel CuAl2O4/MoS2/BaFe12O19 photocatalyst is synthesized that simultaneously couples type I and Z-scheme heterojunctions and exhibits high photocatalytic activity for the degradation of TC under simulated sunlight irradiation.
To cite this article before page numbers are assigned, use the DOI form of citation above.
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WhatsApp private messages to appear on mirrors in restrooms, Anushka Sharma roped in to drive awareness

The messages will appear on special mirrors in restrooms installed at select locations in Delhi and vanish without a trace like disappearing messages, the company said.




drive

Minor’s rape: HC denies rickshaw driver’s bail




drive

Ericsson expects network densification to drive next phase of growth in India

Ericsson estimates that the data traffic in India will grow from 29 GB per smartphone user per month to 68 GB per smartphone user per month by 2029




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Selective enhancement of (6–4) photoproduct formation in dithymine dinucleotides driven by specific sugar puckering

Org. Biomol. Chem., 2024, 22,3025-3034
DOI: 10.1039/D4OB00279B, Paper
Jouda Jakhlal, Clément Denhez, Stéphanie Coantic-Castex, Agathe Martinez, Dominique Harakat, Thierry Douki, Dominique Guillaume, Pascale Clivio
Evidence is presented that (6–4) photoproduct formation between two thymine residues in dinucleotide analogues is significantly and specifically enhanced when the 5''- and 3''-end sugar puckering are mainly north and south, respectively.
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Visible light-driven photocatalytic sulfonative oxidation of benzyl secondary amines

Org. Biomol. Chem., 2024, Accepted Manuscript
DOI: 10.1039/D4OB00348A, Paper
Yong-Xiang Lü, Xinqian Wang, Ying-Ming Pan, Keyume Ablajan
A method for the α-oxidation and sulfonation of benzyl secondary amines was developed utilizing Ir(III) or Eosin Y as the photocatalyst in the presence of O2 as a green oxidant....
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Pandemic: Contactless technology on an overdrive

As demand for travel rises, industry must meet it while ensuring passenger safety




drive

Review unlocking power of people analytics: Vibhu Verma's vision for data-driven workforce

People analytics focuses on leveraging employee data to identify patterns, assess performance, and understand the factors driving engagement and retention.




drive

Towards demand-driven training

Vocational education should involve industry




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Intent-driven User Interfaces

Increasingly when I see designers defaulting to more Ul controls and form elements in software interface designs, I encourage them to consider the implications of intent-driven instructions. Here's why...

For years l've used this image of Adobe Illustrator's user interface evolution to highlight the continuous march of "more features, more Ul" that drives nearly every software company's releases. The end result for end users is more functions they don't know about and don't use. Not great.

So what's the alternative? Perhaps something like Christian Cantrell's Photoshop assistant demos. In this series of videos, Christian uses natural language instructions connected to Photoshop's APIs to do things like mask the subject of a series of photos, blur the background in images, create layers and more. All without needing to know how and without clicking a bunch of windows, icons, menus, and pointers (WIMP).

Intent-driven instructions to mask the subject of multiple images in Photoshop:

Intent-driven instructions to mask the blur the backgrounds of multiple images in Photoshop:

Intent-driven instructions to create layers and objects in Photoshop:

While these kinds of interactions won't immediately replace conventional graphical user interface controls, it's pretty clear they enable a new way of control software with hundreds of features... just tell it what you want to do.




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Framing futures in postdigital education [electronic resource] : critical concepts for data-driven practices / editors, Anders Buch, Ylva Lindberg and Teresa Cerratto Pargman

Cham, Switzerland : Springer, [2024]




drive

Google will now let users manage access to Google Drive files directly from Gmail

The feature will work for Gmail users on the web, on Android, and on iOS



  • Computers & Laptops

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Electromagnetic induction drives electron–hole separation in an optoelectronic nerve conduit to accelerate nerve repair

Mater. Chem. Front., 2024, 8,3758-3769
DOI: 10.1039/D4QM00452C, Research Article
Cijun Shuai, Feng Ding, Xiaosong Chen, Huarui Zhou, Hongyi Qian, Yifeng Wang, Yanyan Chen, Fangwei Qi, Xinna Bai
As a photoelectric material, bismuth sulfide (Bi2S3) can convert light signals into electrical signals and thus hold tremendous promise in constructing wireless electrical stimulation to accelerate nerve regeneration.
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A polar multilayered two-dimensional hybrid perovskite for self-driven X-ray photodetection with a low detection limit

Mater. Chem. Front., 2024, 8,3807-3816
DOI: 10.1039/D4QM00582A, Research Article
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Jingtian Zhang, Wuqian Guo, Haojie Xu, Qingshun Fan, Linjie Wei, Xianmei Zhao, Zhihua Sun, Junhua Luo
We have designed a polar multilayered hybrid perovskite by alloying large cations into the distorted cage, in which a crystal-based photodetector enables dramatic self-powered X-ray detection performance.
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Lily Cole: Technology as a Drive for Social Change | WIRED 2012 | WIRED

Impossible, a platform that encourages people to do things for each other for free, could bring a huge amount of social value, argued founder and former model Lily Cole at Wired 2012. Subscribe to WIRED ►► http://po.st/SubscribeWired Full story: http://www.wired.co.uk/news/archive/2012-10/25/lily-cole-impossible "Technology was never something that I was particularly interested in or would consider myself working in, but I feel inspired by the potential for technology to be the driver for social change," she said. Once Cole had the idea for Impossible, she started to research the gift economy, finding lots of pre-capitalist examples and also examining Wikipedia, whose founder Jimmy Wales has invested in the business. "The amount of stuff that we do for free for each other is bigger than GDP." CONNECT WITH WIRED Web: http://po.st/VideoWired Twitter: http://po.st/TwitterWired Facebook: http://po.st/FacebookWired Google+: http://po.st/GoogleWired Instagram: http://po.st/InstagramWired Magazine: http://po.st/MagazineWired Newsletter: http://po.st/NewslettersWired ABOUT WIRED WIRED brings you the future as it happens - the people, the trends, the big ideas that will change our lives. An award-winning printed monthly and online publication. WIRED is an agenda-setting magazine offering brain food on a wide range of topics, from science, technology and business to pop-culture and politics. Lily Cole: Technology as a drive for social change | WIRED 2012 | WIRED https://www.youtube.com/wireduk




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New LiDAR: Driverless cars are about to get a whole lot better at seeing the world | WIRED Originals

Austin Russell, the founder and CEO of Luminar Technologies, aims to improve the safety of autonomous cars with a single laser




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Behind the numbers with Opta and Audi - A Driven To Win Film | WIRED with Audi

Football is increasingly a data driven game, and clubs are looking at technology to give them the edge. Audi are developing the Audi Player Index with Opta to track players in real time. WIRED went the Audi Cup to find out how.




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Scientist Explains Why Her Lab Taught Rats to Drive Tiny Cars

There's the rat race, and then there are these lab rats who learned to drive tiny cars. WIRED's Matt Simon talked with neuroscientist Kelly Lambert about what her driving rodent experiment can teach us about neuroplasticity and learning new skills.