Works matching DE "MOLECULAR clusters"

Results: 638

Theoretical study on the structures and properties of neutral and anionic molecular clusters Y6Sn0/− (n = 1—12).

Published in:

Journal of Molecular Modeling, 2025, v. 31, n. 5, p. 1, doi. 10.1007/s00894-025-06362-3

By:

Wu, Xinchun;
Yang, Jucai;
Chen, Yaqing;
Dong, Caixia

Publication type:

Article

Diversity of Molecular–Network Conformations in the Over-Stoichiometric Arsenoselenides Covering a Full Thioarsenides Row As 4 Se n (0 ≤ n ≤ 6).

Published in:

Molecules, 2025, v. 30, n. 9, p. 1963, doi. 10.3390/molecules30091963

By:

Shpotyuk, Oleh;
Hyla, Malgorzata;
Lukáčová Bujňáková, Zdenka;
Shpotyuk, Yaroslav;
Boyko, Vitaliy

Publication type:

Article

The Common Concept of Anticooperativity Among Molecules Is Fundamentally Flawed, Based on Novel and Unified Molecular-Wide and Electron Density (MOWeD) Concept of Chemical Bonding.

Published in:

Molecules, 2025, v. 30, n. 9, p. 1944, doi. 10.3390/molecules30091944

By:

Cukrowski, Ignacy;
Zaaiman, Stéfan;
Hussain, Shahnawaz

Publication type:

Article

Effects of Boiling and Storage on Water Quality of Tap Water, Spring Water, and Bottled Water.

Published in:

Water (20734441), 2025, v. 17, n. 9, p. 1330, doi. 10.3390/w17091330

By:

Zha, Yueming;
Cao, Bin;
Ni, Lei;
Huang, Yaoxiong

Publication type:

Article

Identification of Indigenous Thai Phlegmariurus Genotypic Population by Integrating Morphological and Molecular Studies.

Published in:

Plants (2223-7747), 2025, v. 14, n. 9, p. 1400, doi. 10.3390/plants14091400

By:

Chedao, Nusanisa;
Pandey, Avinash Chandra;
Suraninpong, Potjamarn

Publication type:

Article

Unveiling the mechanism of dodecylphosphorylcholine as an extremely promising drug delivery system: From self-assembly clusters to drug encapsulation pathways.

Published in:

PLoS ONE, 2025, v. 20, n. 5, p. 1, doi. 10.1371/journal.pone.0320737

By:

Shu, Qijiang;
Yang, Linjing;
Li, Li;
Lin, Zedong;
Huang, Pengru

Publication type:

Article

Site- and enantioselective B−H functionalization of carboranes.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-59410-0

By:

Lee, Kyungsup;
González-Montiel, Gisela A.;
Eom, Hyeonsik;
Kim, Tae Hyeon;
Noh, Hee Chan;
Farah, Abdikani Omar;
Wise, Henry R.;
Kim, Dongwook;
Cheong, Paul Ha-Yeon;
Lee, Phil Ho

Publication type:

Article

Multi‐Component Spirane Assemblies.

Published in:

Macromolecular Chemistry & Physics, 2018, v. 219, n. 22, p. N.PAG, doi. 10.1002/macp.201800218

By:

Özer, Merve S.;
Mittal, Nikita;
Gaikwad, Sudhakar;
Schmittel, Michael

Publication type:

Article

Ag108(PEt3)24Cl6: A Hexagonal Prismatic Metalloid Cluster.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 70, p. 1, doi. 10.1002/chem.202403838

By:

Kordan, Mike Alexander;
Schrenk, Claudio;
Schnepf, Andreas

Publication type:

Article

A Two‐Step Intermolecular Interaction Of Molecular Macroions With Multivalent Counterions.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 60, p. 1, doi. 10.1002/chem.202402359

By:

Xiao, Kexing;
Zhou, Yifan;
Xu, Xiaohan;
Szymanowski, Jennifer E. S.;
Yang, Yuqing;
Afsari, Bahareh;
Burns, Peter C.;
Liu, Tianbo

Publication type:

Article

Ionic γ‐FeO(OH) Nanocrystal Stabilized by Small Isopolymolybdate Clusters as Reactive Core for Water Oxidation.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 6, p. 1, doi. 10.1002/chem.202203033

By:

Mallick, Laxmikanta;
Chakraborty, Biswarup

Publication type:

Article

Frontispiece: Cluster‐Based Crystalline Materials for Iodine Capture.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 2, p. 1, doi. 10.1002/chem.202380262

By:

Wang, San‐Tai;
Liu, Ya‐Jie;
Zhang, Cheng‐Yang;
Yang, Fan;
Fang, Wei‐Hui;
Zhang, Jian

Publication type:

Article

Cluster‐Based Crystalline Materials for Iodine Capture.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 2, p. 1, doi. 10.1002/chem.202202638

By:

Wang, San‐Tai;
Liu, Ya‐Jie;
Zhang, Cheng‐Yang;
Yang, Fan;
Fang, Wei‐Hui;
Zhang, Jian

Publication type:

Article

The account of atom-pair dispersion interaction on the stabilization of C–H/π bound phenylacetylene–hydrocarbon complexes.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 5, p. 1, doi. 10.1007/s00214-021-02757-6

By:

Khodia, Saurabh;
Halder, Shouvik;
Sarkar, Saibalendu;
Maity, Surajit

Publication type:

Article

The structure of 1,3-butadiene clusters: Benchmarking the density-functional based tight-binding method and finite temperature properties.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 4, p. 1, doi. 10.1007/s00214-021-02742-z

By:

Douady, J.;
Simon, A.;
Rapacioli, M.;
Calvo, F.;
Yurtsever, E.;
Tekin, A.

Publication type:

Article

Vanadium oxide clusters in substellar atmospheres: A quantum chemical study.

Published in:

Astronomy & Astrophysics / Astronomie et Astrophysique, 2024, v. 690, p. 1, doi. 10.1051/0004-6361/202347693

By:

Lecoq-Molinos, H.;
Gobrecht, D.;
Sindel, J. P.;
Helling, Ch.;
Decin, L.

Publication type:

Article

Molecular Modeling of the Thermal Accommodation of Argon Atoms on Clusters of Iron Atoms.

Published in:

High Temperature, 2019, v. 57, n. 4, p. 490, doi. 10.1134/S0018151X19040151

By:

Lenev, D. Yu.;
Norman, G. E.

Publication type:

Article

Netting Crystal Nuclei in Metal–Organic Framework Cavities.

Published in:

Small Structures, 2024, v. 5, n. 12, p. 1, doi. 10.1002/sstr.202400300

By:

Braschinsky, Alan;
Blundell, Toby J.;
Steed, Jonathan W.

Publication type:

Article

Electrophysical properties of Pb 1-XMnX Se epitaxial films irradiated by γ-quanta.

Published in:

Turkish Journal of Physics, 2020, v. 44, n. 2, p. 214, doi. 10.3906/fiz-1906-14

By:

MADATOV, Rahim;
MAMISHOVA, Rakshana;
MAMEDOV, Muslim;
ISMAYILOV, Javanshir;
FARADJOVA, Ulviya

Publication type:

Article

Genetic Diversity and Population Structure of Maize Inbred Lines with Varying Levels of Resistance to Striga hermonthica Using Agronomic Trait-Based and SNP Markers.

Published in:

Plants (2223-7747), 2020, v. 9, n. 9, p. 1223, doi. 10.3390/plants9091223

By:

Stanley, Adekemi;
Menkir, Abebe;
Paterne, Agre;
Ifie, Beatrice;
Tongoona, Pangirayi;
Unachukwu, Nnanna;
Meseka, Silvestro;
Mengesha, Wende;
Gedil, Melaku

Publication type:

Article

Single-Molecule Clustering for Super-Resolution Optical Fluorescence Microscopy.

Published in:

Photonics, 2022, v. 9, n. 1, p. 7, doi. 10.3390/photonics9010007

By:

Joshi, Prakash;
Mondal, Partha Pratim

Publication type:

Article

Effects of small extracellular vesicles derived from normoxia- and hypoxia-treated prostate cancer cells on the submandibular salivary gland epithelium in vitro.

Published in:

Tissue Barriers, 2025, v. 13, n. 1, p. 1, doi. 10.1080/21688370.2024.2347062

By:

Špilak, Ana;
Brachner, Andreas;
Friedl, Heinz-Peter;
Klepe, Adrián;
Nöhammer, Christa;
Neuhaus, Winfried

Publication type:

Article

Formation of luminescent and nonluminescent silver nanoparticles in silicate glasses by near-infrared femtosecond laser pulses and subsequent thermal treatment: the role of halogenides.

Published in:

Optical Engineering, 2016, v. 55, n. 6, p. 1, doi. 10.1117/1.OE.55.6.067101

By:

Klyukin, Dmitry A.;
Dubrovin, Victor D.;
Pshenova, Alisa S.;
Putilin, Sergey E.;
Shakhverdov, Teimur A.;
Tsypkin, Anton N.;
Nikonorov, Nikolay V.;
Sidorov, Alexander I.

Publication type:

Article

Luminescent glass fiber sensors for ultraviolet radiation detection by the spectral conversion.

Published in:

Optical Engineering, 2015, v. 54, n. 11, p. 1, doi. 10.1117/1.OE.54.11.117107

By:

Agafonova, Darina S.;
Kolobkova, Elena V.;
Ignatiev, Alexander I.;
Nikonorov, Nikolay V.;
Shakhverdov, Teimur A.;
Shirshnev, Pavel S.;
Sidorov, Alexander I.;
Vasiliev, Vladimir N.

Publication type:

Article

Intrinsic protein disorder is insufficient to drive subnuclear clustering in embryonic transcription factors.

Published in:

eLife, 2024, p. 1, doi. 10.7554/eLife.88221

By:

Hannon, Colleen E.;
Eisen, Michael B.

Publication type:

Article

Analysis of network expression and immune infiltration of disulfidptosis‐related genes in chronic obstructive pulmonary disease.

Published in:

Immunity, Inflammation & Disease, 2024, v. 12, n. 4, p. 1, doi. 10.1002/iid3.1231

By:

Liu, Yanqun;
Zhu, Tao;
Wang, Juan;
Cheng, Yan;
Zeng, Qiang;
You, Zhangqiang;
Dai, Guangming

Publication type:

Article

Machine learning identification and immune infiltration of disulfidptosis‐related Alzheimer's disease molecular subtypes.

Published in:

Immunity, Inflammation & Disease, 2023, v. 11, n. 10, p. 1, doi. 10.1002/iid3.1037

By:

Zhu, Yidong;
Kong, Lingyue;
Han, Tianxiong;
Yan, Qiongzhi;
Liu, Jun

Publication type:

Article

Diffusion of hydrocarbons diluted in supercritical carbon dioxide.

Published in:

Scientific Reports, 2023, v. 13, n. 1, p. 1, doi. 10.1038/s41598-023-42892-7

By:

Saric, Denis;
Guevara-Carrion, Gabriela;
Gaponenko, Yury;
Shevtsova, Valentina;
Vrabec, Jadran

Publication type:

Article

Comprehensive comparative metabolome study of a large collection of Corsican bryophytes.

Published in:

Frontiers in Plant Science, 2025, p. 1, doi. 10.3389/fpls.2024.1470307

By:

Pannequin, Anaïs;
Muselli, Alain;
Marcourt, Laurence;
Ferreira Queiroz, Emerson;
Quiros-Guerrero, Luis-Manuel;
Asakawa, Yoshinori;
Dounoue-Kubo, Miwa;
Wolfender, Jean-Luc

Publication type:

Article

Incorporating Within-Host Diversity in Phylogenetic Analyses for Detecting Clusters of New HIV Diagnoses.

Published in:

Frontiers in Microbiology, 2022, v. 12, p. 1, doi. 10.3389/fmicb.2021.803190

By:

Guang, August;
Howison, Mark;
Ledingham, Lauren;
D'Antuono, Matthew;
Chan, Philip A.;
Lawrence, Charles;
Dunn, Casey W.;
Kantor, Rami

Publication type:

Article

PREVALENCE, PHENOTYPIC, AND GENOTYPIC ASSESSMENT OF ANTIBIOTIC RESISTANCE, VIRULENCE MARKERS AND MOLECULAR TYPING OF Staphylococcus epidermidis STRAINS ISOLATED FROM BOVINE SUBCLINICAL MASTITIC MILK.

Published in:

Philippine Journal of Veterinary Medicine, 2021, v. 8, n. 1, p. 56

By:

Talebi, Fatemeh;
Momtaz, Hassan;
Bamzadeh, Zahra

Publication type:

Article

Notizen aus der Chemie.

Published in:

Nachrichten aus der Chemie, 2024, v. 72, n. 7, p. 52, doi. 10.1002/nadc.20244144123

By:

Barra, Lena;
Calviño, Céline;
Dierkes, Georg;
Heine, Johanna;
Hoch, Constantin;
Jahn, Ullrich;
Meermann, Björn;
Neudecker, Tim;
Roca Jungfer, Maximilian;
Strub, Erik;
Tambornino, Frank

Publication type:

Article

Double stabilization of silver molecular clusters in thin films.

Published in:

Research on Chemical Intermediates, 2020, v. 46, n. 9, p. 4033, doi. 10.1007/s11164-020-04189-6

By:

Evstropiev, S. K.;
Nikonorov, N. V.;
Saratovskii, A. S.

Publication type:

Article

A density functional study on the aggregation of alumina clusters.

Published in:

Research on Chemical Intermediates, 2017, v. 43, n. 3, p. 1447, doi. 10.1007/s11164-016-2708-3

By:

Wang, Guocheng;
Xiao, Yuanyou;
Song, Yulai;
Zhou, Haichen;
Tian, Qianren;
Li, Fukun

Publication type:

Article

A Ni–Mo Polyoxometalate Based on Octamolybdate: Self-assemble and Application in Hydrotreating Catalyst.

Published in:

Catalysis Letters, 2023, v. 153, n. 2, p. 1, doi. 10.1007/s10562-022-04008-0

By:

Jilei, Liang;
Mengmeng, Wu;
Nianqing, Zhu;
Xinxing, Gao;
Guanxing, Zhu;
Tingting, Huang;
Yunqi, Liu;
Chenguang, Liu

Publication type:

Article

A zero-valent palladium cluster-organic framework.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-45363-3

By:

Liu, Xiyue;
McPherson, James N.;
Andersen, Carl Emil;
Jørgensen, Mike S. B.;
Larsen, René Wugt;
Yutronkie, Nathan J.;
Wilhelm, Fabrice;
Rogalev, Andrei;
Giménez-Marqués, Mónica;
Mínguez Espallargas, Guillermo;
Göb, Christian R.;
Pedersen, Kasper S.

Publication type:

Article

Ce-mediated molecular tailoring on gigantic polyoxometalate {Mo132} into half-closed {Ce11Mo96} for high proton conduction.

Published in:

Nature Communications, 2023, v. 14, n. 1, p. 1, doi. 10.1038/s41467-023-40685-0

By:

Li, Xue-Xin;
Li, Cai-Hong;
Hou, Ming-Jun;
Zhu, Bo;
Chen, Wei-Chao;
Sun, Chun-Yi;
Yuan, Ye;
Guan, Wei;
Qin, Chao;
Shao, Kui-Zhan;
Wang, Xin-Long;
Su, Zhong-Min

Publication type:

Article

Complex phase transitions and phase engineering in the aqueous solution of an isopolyoxometalate cluster.

Published in:

Nature Communications, 2023, v. 14, n. 1, p. 1, doi. 10.1038/s41467-023-38455-z

By:

Wang, Zhi-Da;
Liang, Song;
Yang, Yuqing;
Liu, Zhen-Ning;
Duan, Xiao-Zheng;
Li, Xinpei;
Liu, Tianbo;
Zang, Hong-Ying

Publication type:

Article

Identification of Diverse Maize Inbred Lines using Molecular and Phenotypic Genetic Divergence Analysis.

Published in:

International Journal of Bio-Resource & Stress Management, 2024, v. 15, n. 10, p. 1, doi. 10.23910/1.2024.5543

By:

James, M.;
Krishna, T. P. Ajeesh;
Priyadarsini, V.;
Gladina, Angelin;
Kumar, P. Senthil

Publication type:

Article

SinC13-n (n = 1 - 12) Clusters: An All-electron DFT Investigation.

Published in:

Materials Science / Medziagotyra, 2019, v. 25, n. 2, p. 214, doi. 10.5755/j01.ms.25.2.19077

By:

Xingyu ZHOU;
Zhiqiang DING;
Hao Zhang;
Jin GUO;
Hua NING;
Ying LIU

Publication type:

Article

Exploration of the Existence Forms and Patterns of Dissolved Oxygen Molecules in Water.

Published in:

Nano-Micro Letters, 2024, v. 16, n. 1, p. 1, doi. 10.1007/s40820-024-01427-z

By:

Yuan, Hewei;
Zhang, Yaozhong;
Huang, Xiaolu;
Zhang, Xiwu;
Li, Jinjin;
Huang, Yufeng;
Li, Kun;
Weng, Haotian;
Xu, Yang;
Zhang, Yafei

Publication type:

Article

A two-phase substrate model for enzymatic hydrolysis of lignocellulose: application to batch and continuous reactors.

Published in:

Biotechnology for Biofuels, 2019, v. 12, n. 1, p. 1, doi. 10.1186/s13068-019-1633-2

By:

Lischeske, James J.;
Stickel, Jonathan J.

Publication type:

Article

Stabilizing Decavanadate Cluster as Electrode Material in Sodium and Lithium‐ion Batteries.

Published in:

ChemSusChem, 2023, v. 16, n. 24, p. 1, doi. 10.1002/cssc.202300631

By:

Ghosh, Meena;
Sorsche, Dieter;
Binte Ahmed, Rezwana;
Anjass, Montaha

Publication type:

Article

Introducing KICK-MEP: exploring potential energy surfaces in systems with significant non-covalent interactions.

Published in:

Journal of Molecular Modeling, 2024, v. 30, n. 11, p. 1, doi. 10.1007/s00894-024-06155-0

By:

García-Argote, Williams;
Ruiz, Lina;
Inostroza, Diego;
Cardenas, Carlos;
Yañez, Osvaldo;
Tiznado, William

Publication type:

Article

Theoretical study on multi-perspective interaction analysis of ADN and ADN-H2O-CH3OH solutions.

Published in:

Journal of Molecular Modeling, 2024, v. 30, n. 10, p. 1, doi. 10.1007/s00894-024-06130-9

By:

Tang, Li;
Wang, Lin-yan;
Han, Jian-hui;
Ye, Ji-fei;
Yuan, Jun

Publication type:

Article

Total absorption spectrum of benzene aggregates obtained from two different approaches.

Published in:

Journal of Molecular Modeling, 2024, v. 30, n. 3, p. 1, doi. 10.1007/s00894-024-05859-7

By:

Montserrat, Ricardo;
Oliveira, Ricardo R.;
Rocha, Alexandre B.

Publication type:

Article

Molecular docking studies of natural immunomodulators indicate their interactions with the CD40L of CD40/CD40L pathway and CSF1R kinase domain of microglia.

Published in:

Journal of Molecular Modeling, 2022, v. 28, n. 4, p. 1, doi. 10.1007/s00894-022-05084-0

By:

Maurya, Shashank Kumar;
Mishra, Rajnikant

Publication type:

Article

Density functional theory study of π-aromatic interaction of benzene, phenol, catechol, dopamine isolated dimers and adsorbed on graphene surface.

Published in:

Journal of Molecular Modeling, 2019, v. 25, n. 10, p. N.PAG, doi. 10.1007/s00894-019-4185-2

By:

de Moraes, Elizane E.;
Tonel, Mariana Z.;
Fagan, Solange B.;
Barbosa, Marcia C.

Publication type:

Article

Supercell calculations of the geometry and lattice energy of α-glycine crystal.

Published in:

Journal of Molecular Modeling, 2019, v. 25, n. 8, p. N.PAG, doi. 10.1007/s00894-019-4124-2

By:

Xavier, Neubi F.;
Da Silva, Antônio M.;
Bauerfeldt, Glauco Favilla

Publication type:

Article

Knowledge discovery through chemical space networks: the case of organic electronics.

Published in:

Journal of Molecular Modeling, 2019, v. 25, n. 4, p. N.PAG, doi. 10.1007/s00894-019-3950-6

By:

Kunkel, Christian;
Schober, Christoph;
Oberhofer, Harald;
Reuter, Karsten

Publication type:

Article