ri

Synthesis of different types of nano-hydroxyapatites for efficient photocatalytic degradation of textile dye (Congo red): a crystallographic characterization

RSC Adv., 2024, 14,11570-11583
DOI: 10.1039/D3RA08527A, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Md. Kawsar, Md. Sahadat Hossain, Sumaya Tabassum, Newaz Mohammed Bahadur, Samina Ahmed
Exploration of the crystallographic parameters of various nano-hydroxyapatites for enhanced photocatalytic degradation of Congo red dye.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Fluorinated carbon as high-performance cathode for aqueous zinc primary batteries

RSC Adv., 2024, 14,12454-12462
DOI: 10.1039/D4RA00835A, Paper
Open Access
Congping Xu, Liang Zhang, Fupeng Liu, Ruding Zhang, Hongjun Yue
Fluorinated carbon was employed as a cathode active substance for aqueous zinc batteries for the first time.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Influence of potassium doping on the structural, conduction mechanism, and dielectric properties of CaFe2O4

RSC Adv., 2024, 14,12464-12474
DOI: 10.1039/D4RA00260A, Paper
Open Access
Mohamed Mounir Bouzayani, Manel Ben Abdessalem, Ibtihel Soudani, Abderrazek Oueslati, Abdelhedi Aydi
The frequency and temperature-related dielectric relaxation and electrical conduction mechanisms in potassium-doped CaFe2O4 oxide ceramic were investigated in this study throughout a temperature range of 313–673 K.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Correction: 2-cyanopyridine derivatives enable N-terminal cysteine bioconjugation and peptide bond cleavage of glutathione under aqueous and mild conditions

RSC Adv., 2024, 14,12416-12416
DOI: 10.1039/D4RA90039A, Correction
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Tetsuya Yano, Takahiro Yamada, Hiroaki Ishida, Nami Ohashi, Toshimasa Itoh
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

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.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Enhanced acetone gas-sensing characteristics of Pd–NiO nanorods/SnO2 nanowires sensors

RSC Adv., 2024, 14,12438-12448
DOI: 10.1039/D4RA01265H, Paper
Open Access
Nguyen Phu Hung, Nguyen Van Duy, Chu Thi Xuan, Dang Thi Thanh Le, Chu Manh Hung, Han Jin, Nguyen Duc Hoa
The ternary component consisting of SnO2 nanowires/Pd–NiO nanorods is employed to enhance the acetone gas sensor performance utilizing the synergistic effects of the p–n heterojunction between the p-type NiO and the n-type SnO2, as well as the catalytic spillover effect of Pd nanoparticles.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Retraction: Synthesis and characterization of a supported Pd complex on volcanic pumice laminates textured by cellulose for facilitating Suzuki–Miyaura cross-coupling reactions

RSC Adv., 2024, 14,12463-12463
DOI: 10.1039/D4RA90042A, Retraction
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Siavash Salek Soltani, Reza Taheri-Ledari, S. Morteza F. Farnia, Ali Maleki, Alireza Foroumadi
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Harnessing the power of natural deep eutectic solvents (choline chloride/sucrose) and polypropylene glycol in the formation of aqueous biphasic systems and the application of these systems in drug extraction

RSC Adv., 2024, 14,12349-12359
DOI: 10.1039/D3RA07066B, Paper
Open Access
Fariba Ghaffari, Mohammed Taghi Zafarani-Moattar, Hemayat Shekaari
In recent times, there has been considerable interest in utilizing aqueous biphasic systems (ABSs) containing natural deep eutectic solvents (NADESs) for the extraction of various substances.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Synergistic effects of β-NaFeO2 ferrite nanoparticles for photocatalytic degradation, antibacterial, and antioxidant applications

RSC Adv., 2024, 14,12513-12527
DOI: 10.1039/D4RA02430C, Paper
Open Access
Tahira Jabeen, Muhammad Shahid Khan, Sana Javaid, Waqar Azeem, Rabia Ayoub, Martin Motola
Detailed antibacterial mechanism using by synthesized β-NaFeO2.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Investigating Fe-doped Ba0.67Ni0.33Mn1−xFexO3 (x = 0, 0.2) ceramics: insights into electrical and dielectric behaviors

RSC Adv., 2024, 14,12561-12573
DOI: 10.1039/D4RA01581A, Paper
Open Access
Faouzia Tayari, Kais Iben Nassar, Saja Algessair, Mokhtar Hjiri, Majdi Benamara
This study investigates the characteristics of Ba0.67Ni0.33Mn1–xFexO3 perovskite under varying Fe doping levels at the Mn-site (x = 0, 0.2). X-ray diffraction confirm the material's consistent structure, with Fe3+ ions substituting Mn3+ ions while maintaining identical ionic radius.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Synthesis and characterization of a nanostructure conductive copolymer based on polyaniline and polylactic acid as an effective substrate in proteins impedimetric biosensing

RSC Adv., 2024, 14,12600-12611
DOI: 10.1039/D4RA01061B, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Ehsan Dinpanah, Moslem Mansour Lakouraj, Ebrahim Fooladi, Vahid Hasantabar
Despite of all the developments in DNA microarray technology, there is not sufficient knowledge about protein abundance or their function in processes such as proteolysis, phosphorylation.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Significantly enhanced catalytic performance of Pd nanocatalyst on AlOOH featuring abundant solid surface frustrated Lewis pair for improved hydrogen activation

RSC Adv., 2024, 14,12593-12599
DOI: 10.1039/D4RA01852D, Paper
Open Access
Junwei Li, Hongshuai Yin, Sisi Liu, Chaofa Xu, Zhixiong Cai
The superior catalytic performance of Pd nanocatalysts in AlOOH-80 is attributed to solid surface frustrated Lewis pairs (ssFLP), which enhance hydrogen gas dissociation, improve Pd nanocatalyst hydrogenation, and result in high catalytic activity of Pd/AlOOH-80.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Correction: Facile fabrication of a graphene-based chemical sensor with ultrasensitivity for nitrobenzene

RSC Adv., 2024, 14,12633-12633
DOI: 10.1039/D4RA90041C, Correction
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Ali Raza, Zaka Ullah, Adnan Khalil, Rashida Batool, Sajjad Haider, Kamran Alam, Nazmina Imrose Sonil, Alvi Muhammad Rouf, Muhammad Faizan Nazar
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Thermally modified nanocrystalline snail shell adsorbent for methylene blue sequestration: equilibrium, kinetic, thermodynamic, artificial intelligence, and DFT studies

RSC Adv., 2024, 14,12703-12719
DOI: 10.1039/D4RA01074D, Paper
Open Access
Abisoye Abidemi Adaramaja, Abayomi Bamisaye, Shakirudeen Modupe Abati, Kayode Adesina Adegoke, Morenike Oluwabunmi Adesina, Ayodeji Rapheal Ige, Oluwatobi Adeleke, Mopelola Abidemi Idowu, Abel Kolawole Oyebamiji, Olugbenga Solomon Bello
The quest for an efficient and sustainable adsorbent material that can effectively remove harmful and hazardous dyes from industrial effluent has become more intense. Thermally modified nanocrystalline snail shell is a new biosorbent for removing methylene blue dye from contaminated wastewater.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Insight into the probability of ethoxy(pentafluoro)cyclotriphosphazene (PFPN) as the functional electrolyte additive in lithium–sulfur batteries

RSC Adv., 2024, 14,12754-12761
DOI: 10.1039/D3RA08379A, Paper
Open Access
Ning Li, Yu Zhang, Shun Zhang, Lu Shi, Jie-Yu Zhang, Ke-Meng Song, Jin-Chun Li, Fang-Lei Zeng
Enhancing the flame retardancy of electrolytes and the stability of lithium anodes is of great significance to improve the safety performance of lithium–sulfur (Li–S) batteries.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Design, synthesis and antiproliferative evaluation of tetrahydro-β-carboline histone deacetylase inhibitors bearing an aliphatic chain linker

RSC Adv., 2024, 14,12762-12771
DOI: 10.1039/D4RA01672F, Paper
Open Access
Jing Shi, Jiayun Wang, Xingjie Wang, Chao Qu, Changchun Ye, Xiuli Li, Xin Chen, Zhengshui Xu
The use of histone deacetylase inhibitors (HDACis) is an effective approach for cancer treatment.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Fabrication of MoS2/rGO hybrids as electrocatalyst for water splitting applications

RSC Adv., 2024, 14,12742-12753
DOI: 10.1039/D4RA00697F, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Muhammad Shahzeb Khan, Tayyaba Noor, Erum Pervaiz, Naseem Iqbal, Neelam Zaman
Environmental degradation and energy constraint are important risks to long-term sustainability in the modern world.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Treatment of carbon electrodes with Ti3C2Tx MXene coating and thermal method for vanadium redox flow batteries: a comparative study

RSC Adv., 2024, 14,12807-12816
DOI: 10.1039/D4RA01380H, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Kavin Teenakul, Sayed Ali Ahmad Alem, Ritambhara Gond, Anupma Thakur, Babak Anasori, Amirreza Khataee
Treatment of carbon papers with Ti3C2Tx MXene solution for vanadium redox flow batteries.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Engineering gold nanoworms with tunable longitudinal plasmon peak in the near infrared and their refractive index sensing properties

RSC Adv., 2024, 14,12772-12780
DOI: 10.1039/D4RA00994K, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Misbah ul Ain, Asma, Rizwan Ullah, Zanjbeel Fatima, Ahsan Illahi, Waqqar Ahmed
Gold nanoworms (NWs), synthesized in a one-step reaction with size controlled by pH, show tunable plasmon peaks in the near-infrared. Finite element analysis validates their optical properties, and they exhibit sensitive refractive index sensing.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Novel supramolecular luminescent metallogels containing Tb(III) and Eu(III) ions with benzene-1,3,5-tricarboxylic acid gelator: advancing semiconductor applications in microelectronic devices

RSC Adv., 2024, 14,12829-12840
DOI: 10.1039/D3RA07903A, Paper
Open Access
Subhendu Dhibar, Aiswarya Mohan, Kripasindhu Karmakar, Bijnaneswar Mondal, Arpita Roy, Saranya Babu, Parul Garg, Pradip Ruidas, Subham Bhattacharjee, Sanjay Roy, Ashok Bera, Soumya Jyoti Ray, Padmanabhan Predeep, Bidyut Saha
Supramolecular metallogels with Tb(III)- and Eu(III)-ions, formed using benzene-1,3,5-tricarboxylic acid, display remarkable stability at room temperature. They hold promise for use in electronics, notably as reliable ambient Schottky barrier diodes.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Use of benzothiophene ring to improve the photovoltaic efficacy of cyanopyridinone-based organic chromophores: a DFT study

RSC Adv., 2024, 14,12841-12852
DOI: 10.1039/D3RA06817J, Paper
Open Access
Iqra Shafiq, Muhammad Khalid, Gul Maria, Nadeem Raza, Ataualpa A. C. Braga, Saifullah Bullo, Mohamed Khairy
The benzothiophene based chromophores (A1D1–A1D5) with A–π–A configuration were designed via end-capped tailoring with benzothiophene type acceptors using reference compound (A1R).
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Nickel-catalyzed γ-alkylation of cyclopropyl ketones with unactivated primary alkyl chlorides: balancing reactivity and selectivity via halide exchange

RSC Adv., 2024, 14,12883-12887
DOI: 10.1039/D4RA02616K, Paper
Open Access
Zheng-Ying Wang, Shi-Zheng Liu, Cong Guo, Yi-Zheng Cheng, Qiang Li, Jianmin Dou, Dacheng Li
Nickel-catalyzed cross-electrophile coupling of cyclopropyl ketones and alkyl chlorides. High reactivity and selectivity can be achieved with sodium iodide as a cocatalyst that generates a low concentration of alkyl iodide via halide exchange.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

The influence of hydrogen bonding on the structure of organic–inorganic hybrid catalysts and its application in the solvent-free epoxidation of α-olefins

RSC Adv., 2024, 14,12853-12863
DOI: 10.1039/D4RA01399A, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Hong-Bin Ju, Li-Zhi Zhang, De-Bao Li, Tao Geng, Ya-Jie Jiang, Ya-Kui Wang
Different reaction routes with the influence of hydrogen bonding and without hydrogen bonding.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Rational design of a lysosome-targeted fluorescent probe for monitoring the generation of hydroxyl radicals in ferroptosis pathways

RSC Adv., 2024, 14,12864-12872
DOI: 10.1039/D4RA00562G, Paper
Open Access
Lili Zhong, Datian Fu, Jin Xu, Linyan Tan, Haimei Wu, Min Wang
A novel hydrocyanine-based turn-on fluorescence probe HCy-Lyso, with excellent lysosome-targeting ability and ˙OH-responsive efficiency, has been applied for monitoring the variation in lysosomal ˙OH levels during ferroptosis.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Wet adhesive hydrogels based on niobium carbide for experimental research of oral mucosal impairment

RSC Adv., 2024, 14,12935-12946
DOI: 10.1039/D4RA01352B, Paper
Open Access
Jiayuan Chen, Junyu Ren, Yingjie Wu, Narisu Hu, Fang Zhao, Lin Zhang
Illustration of the mechanism of NbC/TA–GelMA hydrogel with multifunctional properties for potential application in oral mucosal impairment.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Smart materials for flexible electronics and devices: hydrogel

RSC Adv., 2024, 14,12984-13004
DOI: 10.1039/D4RA01168F, Review Article
Open Access
Taposhree Dutta, Pavan Chaturvedi, Ignacio Llamas-Garro, Jesús Salvador Velázquez-González, Rakesh Dubey, Satyendra Kumar Mishra
In recent years, flexible conductive materials have attracted considerable attention for their potential use in flexible energy storage devices, touch panels, sensors, memristors, and other applications.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Superhydrophobic foam combined with biomass-derived TENG based on upcycled coconut husk for efficient oil–water separation

RSC Adv., 2024, 14,13005-13015
DOI: 10.1039/D4RA01841A, Paper
Open Access
Jiaming Liang, Yajuan Zhou, Qian Wu, Zeying Zhu, Keda Lin, Jinsheng He, Haihe Hong, Yuanzheng Luo
Ocean ecological environments are seriously affected by oil spilling and plastic-debris, significantly reducing marine pollution via using biocomposite production from natural fiber reinforcement is a friendly way to deal with marine oil pollution.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Development of an imidazole-based N,N-bidentate ligand for the manganese catalyzed direct coupling of nitriles with alcohols

RSC Adv., 2024, 14,12978-12982
DOI: 10.1039/D4RA00817K, Paper
Open Access
Qian Tang, Dingguo Song, Kali Zhang, Wenhao Mao, Xianghua Zhao, Ding Du, Fei Ling, Weihui Zhong
This work describes the manganese catalyzed direct coupling of nitriles with alcohols with assistance of a set of simple and new imidazole-based N,N-bidentate ligands.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Efficient dye adsorption of mesoporous activated carbon from bamboo parenchyma cells by phosphoric acid activation

RSC Adv., 2024, 14,12873-12882
DOI: 10.1039/D4RA01652A, Paper
Open Access
Yuxuan Yao, Haifeng Zuo, Yijing Liu, Shenghua Pang, Liuqian Lan, Futi Yao, Yongyi Wu, Zhigao Liu
In this study, mesoporous activated carbon was prepared from bamboo parenchyma cells for MB removal from water.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

ProteoMutaMetrics: machine learning approaches for solute carrier family 6 mutation pathogenicity prediction

RSC Adv., 2024, 14,13083-13094
DOI: 10.1039/D4RA00748D, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Jiahui Huang, Tanja Osthushenrich, Aidan MacNamara, Anders Mälarstig, Silvia Brocchetti, Samuel Bradberry, Lia Scarabottolo, Evandro Ferrada, Sergey Sosnin, Daniela Digles, Giulio Superti-Furga, Gerhard F. Ecker
Predict SLC6 mutation clinical pathogenicity by calculating the amino acid descriptors in different ranges with rationalization analysis of the prediction.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Antioxidant-rich brilliant polymeric nanocomposites for quick and efficient non-enzymatic hydrogen peroxide sensor

RSC Adv., 2024, 14,13142-13156
DOI: 10.1039/D4RA01768D, Paper
Open Access
M. S. Hashem, Hend S. Magar, Asmaa M. Fahim, Rokaya A. Sobh
New polymeric nanocomposites with metal oxide nanoparticles enhance electrical impedance ratings, offer energy storage and supercapacitors, and enable rapid creation of hydrogen peroxide sensors through microemulsion polymerization.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Exploring the synthetic potential of epoxide ring opening reactions toward the synthesis of alkaloids and terpenoids: a review

RSC Adv., 2024, 14,13100-13128
DOI: 10.1039/D4RA01834F, Review Article
Open Access
Madiha Hanif, Ameer Fawad Zahoor, Muhammad Jawwad Saif, Usman Nazeer, Kulsoom Ghulam Ali, Bushra Parveen, Asim Mansha, Aijaz Rasool Chaudhry, Ahmad Irfan
Epoxides are oxygen containing three-membered heterocycles which can undergo ring opening reactions. These reactions have been significantly employed in the synthesis of alkaloids and terpenoids-based natural products.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Regioselective C(sp2)–H halogenation of pyrazolo[1,5-a]pyrimidines facilitated by hypervalent iodine(III) under aqueous and ambient conditions

RSC Adv., 2024, 14,13095-13099
DOI: 10.1039/D4RA02090A, Paper
Open Access
Abhinay S. Chillal, Rajesh T. Bhawale, Umesh A. Kshirsagar
An efficient and mild approach has been developed for the regio-selective direct C3 halogenation of pyrazolo[1,5-a]pyrimidines employing readily available potassium halide salts and a hypervalent iodine(III) reagent at ambient temperature.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Grind, shine and detect: mechanochemical synthesis of AIE-active polyaromatic amide and its application as molecular receptor of monovalent anions or nucleotides

RSC Adv., 2024, 14,13227-13236
DOI: 10.1039/D4RA02129K, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Jakub S. Cyniak, Artur Kasprzak
The mechanochemical synthesis of AIE-active amide, as well as the application of the title compound as molecular receptor of monovalent anions and nucleotides, are described.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Formation of H-bonding networks in the solid state structure of a trinuclear cobalt(III/II/III) complex with N2O2 donor Schiff base ligand and glutaric acid as bridging co-ligand: synthesis, structure and DFT study

RSC Adv., 2024, 14,13200-13208
DOI: 10.1039/D3RA07697K, Paper
Open Access
Sovana Maity, Sudip Bhunia, Michael G. B. Drew, Rosa M. Gomila, Antonio Frontera, Shouvik Chattopadhyay
Formation of hydrogen bonding network in a trinuclear linear mixed-valence centrosymmetric cobalt(III)–cobalt(II)–cobalt(III) complex has been analyzed using DFT calculations.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Dispersive micro solid phase extraction of glibenclamide from plasma, urine, and wastewater using a magnetic molecularly imprinted polymer followed by its determination by a high-performance liquid chromatography-photodiode array detector

RSC Adv., 2024, 14,13168-13179
DOI: 10.1039/D4RA00452C, Paper
Open Access
Najmeh Sabbaghi, Shayessteh Dadfarnia, Ali Mohammad Haji Shabani, Majid Farsadrooh
The present study describes the development of a simple and selective analytical method for dispersive micro solid phase extraction and determination of glibenclamide (GLB) using magnetic molecularly imprinted polymer (MMIP) as a sorbent.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

1D hollow tubular/2D nanosheet hybrid dimensional porous carbon prepared by one-step carbonization using natural minerals as templates for supercapacitors

RSC Adv., 2024, 14,13190-13199
DOI: 10.1039/D4RA01873G, Paper
Open Access
Fangfang Liu, Chao Zhang, Weiwei Huang, Lei Chen, Yuanshuang Wang, Jinan Niu, Xiuyun Chuan
1D hollow tubular/2D nanosheet hybrid dimensional porous carbon was synthesized through one-step carbonization using 1D fibrous brucite and 2D layered magnesium carbonate hydroxide as templates.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Bishydrazone ligand and its Zn-complex: synthesis, characterization and estimation of scalability inhibition mitigation effectiveness for API 5L X70 carbon steel in 3.5% NaCl solutions

RSC Adv., 2024, 14,13258-13276
DOI: 10.1039/D4RA00404C, Paper
Open Access
Ola. A. El-Gammal, Dina A. Saad, Marwa N. El-Nahass, Kamal Shalabi, Yasser M. Abdallah
Zn-complex: characterization and estimation of scalability inhibition mitigation effectiveness for API 5L X70 carbon steel in 3.5% NaCl solutions.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Tight-binding model describes frontier orbitals of non-fullerene acceptors

Mol. Syst. Des. Eng., 2024, 9,382-398
DOI: 10.1039/D3ME00195D, Paper
Vishal Jindal, Michael J. Janik, Scott T. Milner
HOMO and LUMO of conjugated molecules as superposition of HOMO and LUMO of individual moieties.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Mesoporous degradable chitosan-based monoliths: synthesis and applications toward water purification

Mol. Syst. Des. Eng., 2024, 9,399-408
DOI: 10.1039/D3ME00180F, Paper
Jyoti Devi Katiyar, Subrata Chattopadhyay
A synthetic strategy is presented for the preparation of degradable chitosan based functional porous polymer monoliths with tunable surface area, which are capable to efficiently remove multiple pollutants from water.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Designing biphenanthridine-based singlet fission materials using computational chemistry

Mol. Syst. Des. Eng., 2024, 9,423-435
DOI: 10.1039/D3ME00181D, Paper
Keighlynn A. Veilleux, Georg Schreckenbach, David E. Herbert
A systematic search for novel singlet fission materials based on the recently synthesized 6,6'-biphenanthridine (biphe) framework is reported, utilizing a straightforward computational approach.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Two-state nanocomposite based on symmetric diblock copolymer and planar nanoparticles: mesoscopic simulation

Mol. Syst. Des. Eng., 2024, 9,409-422
DOI: 10.1039/D3ME00176H, Paper
Maxim Malyshev, Daria Guseva, Pavel Komarov
A method for controlling the distribution and orientation of 2D fillers in the copolymer matrix is presented.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

3-Perfluoroalkylated fluorescent coumarin dyes: rational molecular design and photophysical properties

Mol. Syst. Des. Eng., 2024, 9,332-344
DOI: 10.1039/D4ME00006D, Paper
Ayano Ikemura, Yukiko Karuo, Yuki Uehashi, Tomohiro Agou, Masahiro Ebihara, Yasuhiro Kubota, Toshiyasu Inuzuka, Masaaki Omote, Kazumasa Funabiki
The photochemical properties of a coumarin derivative with a promising electron-withdrawing fluoroalkyl group at the 3-position in solution and in the crystal were investigated in detail.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Augmentation of inductive effects through short range intramolecular hydrogen bonds for the improvement of cooperativity of trimeric rosettes

Mol. Syst. Des. Eng., 2024, 9,345-351
DOI: 10.1039/D4ME00008K, Paper
Andre Nicolai Petelski, Tamara Bundrea, Nélida María Peruchena
Three key design elements improve the binding strength of trimeric rosettes: the direction of hydrogen bonds, the addition of groups with inductive effects, and the presence of ambifunctional intramolecular hydrogen bonds between the substituents.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Effect of computationally designed fragment-based analogs on the RBD–ACE2 complex of the SARS-CoV-2 P.1 variant

Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D3ME00193H, Paper
Surabhi Lata, Mohd. Akif
Modulation of the RBD–ACE2 complex formation and perturbation in their interface by the designed analogs.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Engineering the interaction of short antimicrobial peptides with bacterial barriers

Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D4ME00021H, Minireview
Open Access
Costanza Montis, Elisa Marelli, Francesco Valle, Francesca Baldelli Bombelli, Claudia Pigliacelli
Designing short antimicrobial peptides and tuning their interaction with bacterial barriers.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

The fabrication of the photothermal antibacterial platform for bacterial infectious skin wound healing: A review

Mol. Syst. Des. Eng., 2024, Accepted Manuscript
DOI: 10.1039/D4ME00010B, Review Article
Mei Han, Wenjing Sun, Yi Chen, Hongbin Li
Antibiotics are currently the main strategy to treat bacterial infections, but they can cause bacterial resistance, and it is urgent to solve this problem. The emergence of photothermal therapy provides...
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Tuning the photophysical properties of ESIPT active unsymmetrical azine dyes by the change in the substituent and solvent: TD-PBE0 and TD-CAM-B3LYP studies

Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D4ME00039K, Paper
Hossein Roohi, Tahereh Pouryahya
The photophysical properties of the designed ESIPT active as well as donor–acceptor structured unsymmetrical azine dyes L1L5 were investigated at PBE0/6-31++G(d,p) and CAM-B3LYP/6-31++G(d,p) levels of theory in the gas phase and solvent media.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Design and engineering of an artificial disulfide bond in human cytochrome c to regulate the protein structure and function

Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D3ME00196B, Paper
Yan-Yan Li, Yu Feng, Lu Yu, Shuang-Shuang Long, Shu-Qin Gao, Ying-Wu Lin
An artificial disulfide bond was rationally constructed in human cytochrome c (hCyt c) via double mutations (A51C/G77C), which weakened the coordination of Met80 to the heme iron and enhanced the peroxidase activity of hCyt c.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




ri

Hard carbon derived from Physalis alkekengi L. husks as a stable anode for sodium-ion batteries

Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D4ME00007B, Paper
Open Access
  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Liying Liu, Henry R. Tinker, Yusheng Wu, Jiaqi Lv, Laishi Li, Yingjiao Fang, Yuhan Wu, Yang Xu
Physalis alkekengi L. husk-derived hard carbon is firstly investigated as the anode of sodium-ion batteries and demonstrates the great possibility of practical application.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry