Search Results - "Harding ME"

LOS CAMINOS DE WILLIAM CHRISTIAN.

Authors: MEDEIROS, ANTÓNIO¹ antonio.medeiros@iscte-iul.pt

Source: Arxiu d'Etnografia de Catalunya. 2019, Vol. 20, p253-289. 37p.

Exploring New Azobenzene Type Photoswitches by Machine Learning with Lowest Possible Fluorescence Excitons with Ease of Synthesis.

Authors: Waheeb, Azal S. Hasan, Duha M. Mallah, Shaimaa H. et al.

Source: Journal of Fluorescence. Nov2025, Vol. 35 Issue 11, p10701-10712. 12p.

Dehumanizing the human, humanizing the machine: organic consciousness as a hallmark of the persistence of the human against the backdrop of artificial intelligence.

Authors: Torres-Martínez, Sergio¹, surtr_2000@yahoo.es

Source: AI & Society; Aug2025, Vol. 40 Issue 6, p4635-4653, 19p

All paths lead to hubs in the spectroscopic networks of water isotopologues H2¹⁶O and H2¹⁸O.

Authors: Tóbiás, Roland Diouf, Meissa L. Cozijn, Frank M. J. et al.

Source: Communications Chemistry. 2/16/2024, Vol. 7, p1-9. 9p.

Design and investigation of novel iridoid-based peptide conjugates for targeting EGFR and its mutants L858R and T790M/L858R/C797S: an in silico study.

Authors: Das A Biggs MA Hunt HL et al.

Source: Molecular diversity [Mol Divers] 2025 Jun; Vol. 29 (3), pp. 2517-2541. Date of Electronic Publication: 2024 Oct 19.

Publication Type: Journal Article

Journal Info: Publisher: ESCOM Science Publishers Country of Publication: Netherlands NLM ID: 9516534 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1573-501X (Electronic) Linking ISSN: 13811991 NLM ISO Abbreviation: Mol Divers Subsets: MEDLINE

Hydroboration of phenylmethanimine-borane: synchronicity/nonsynchronicity in a double/single hydrogen transfer reaction.

Authors: Fišić, Nikola Milovanović, Branislav Petković, Milena

Source: Theoretical Chemistry Accounts: Theory, Computation, & Modeling. Jul2025, Vol. 144 Issue 7, p1-10. 10p.

One Pipeline and Two Impact Assessments: Coproduction, Legal Pluralism, and the Trans Mountain Expansion Project.

Authors: Stewart IG Harding ME

Source: Science, technology & human values [Sci Technol Human Values] 2023 May; Vol. 48 (3), pp. 525-551. Date of Electronic Publication: 2021 Dec 27.

Publication Type: Journal Article

Journal Info: Publisher: MIT Press Country of Publication: United States NLM ID: 9440757 Publication Model: Print-Electronic Cited Medium: Print ISSN: 0162-2439 (Print) Linking ISSN: 01622439 NLM ISO Abbreviation: Sci Technol Human Values Subsets: PubMed not MEDLINE

Utilizing Experiment and Theory to Evaluate Rhodamine B ethylenediamine as a Fluorescent Sensor for G-type Nerve Agents.

Authors: Hamstra, Anna Cai, Yajie Reynolds, Zachary et al.

Source: Journal of Fluorescence. May2022, Vol. 32 Issue 3, p961-967. 7p.

Binding free energies for the SAMPL8 CB8 "Drugs of Abuse" challenge from umbrella sampling combined with Hamiltonian replica exchange.

Authors: Markthaler, Daniel Kraus, Hamzeh Hansen, Niels

Source: Journal of Computer-Aided Molecular Design; Jan2022, Vol. 36 Issue 1, p1-9, 9p

Computational modeling of the Nb ... -CO chemisorption process.

Authors: Costa CVS de Souza Barbosa L Gargano R et al.

Source: Journal of molecular modeling [J Mol Model] 2024 Nov 18; Vol. 30 (12), pp. 406. Date of Electronic Publication: 2024 Nov 18.

Publication Type: Journal Article

Journal Info: Publisher: Springer Country of Publication: Germany NLM ID: 9806569 Publication Model: Electronic Cited Medium: Internet ISSN: 0948-5023 (Electronic) Linking ISSN: 09485023 NLM ISO Abbreviation: J Mol Model Subsets: MEDLINE; PubMed not MEDLINE

Three decades of quantum science: how quantum chemistry transformed thermochemical database generation for benchmarking DFT and machine learning.

Authors: Karton, Amir¹ (AUTHOR) amir.karton@une.edu.au

Source: Australian Journal of Chemistry. 2025, Vol. 78 Issue 3, p1-15. 15p.

Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge.

Authors: Bergazin, Teresa Danielle Tielker, Nicolas Zhang, Yingying et al.

Source: Journal of Computer-Aided Molecular Design; Jul2021, Vol. 35 Issue 7, p771-802, 32p

Computational chemistry methods based on MNDO and tools for improving their accuracy.

Authors: Stewart JJP; Stewart Computational Chemistry, 15210 Paddington Circle, Colorado Springs, CO, 80921, USA. mrmopac@att.net.

Source: Journal of molecular modeling [J Mol Model] 2026 Mar 13; Vol. 32 (4). Date of Electronic Publication: 2026 Mar 13.

Publication Type: Journal Article

Journal Info: Publisher: Springer Country of Publication: Germany NLM ID: 9806569 Publication Model: Electronic Cited Medium: Internet ISSN: 0948-5023 (Electronic) Linking ISSN: 09485023 NLM ISO Abbreviation: J Mol Model Subsets: MEDLINE; PubMed not MEDLINE

Lighting up aggregate emission of perylene diimide by leveraging polymerization-mediated through-space charge transfer and π-π stacking.

Authors: Ye, Suiying Füglistaller, Désirée Tian, Tian et al.

Source: SCIENCE CHINA Chemistry. Dec2024, Vol. 67 Issue 12, p4218-4233. 16p.

Low‐budget, single‐session elimination of CIED pocket infection.

Authors: Roshdy, Hisham Seaoud, Elshaimaa Elbelbesy, Radwa

Source: Pacing & Clinical Electrophysiology. Jan2021, Vol. 44 Issue 1, p129-134.

Structural and Electronic (Absorption and Fluorescence) Properties of a Stable Triplet Diphenylcarbene: A DFT Study.

Authors: Hassan, Abrar Ul Mohyuddin, Ayesha Nadeem, Sohail et al.

Source: Journal of Fluorescence. Sep2022, Vol. 32 Issue 5, p1629-1638. 10p.

Multireference calculations on bond dissociation and biradical polycyclic aromatic hydrocarbons as guidance for fractional occupation number weighted density analysis in DFT calculations.

Authors: Carvalho, Jhonatas R. Nieman, Reed Kertesz, Miklos et al.

Source: Theoretical Chemistry Accounts: Theory, Computation, & Modeling. Oct2024, Vol. 143 Issue 10, p1-12. 12p.

How the two-center three-electron hemibond affect the inversion barrier of NH3 in X-NH3 complex (X = F, Cl and Br).

Authors: Kumar, Amit Kumar, Pradeep

Source: Journal of Chemical Sciences. Sep2024, Vol. 136 Issue 3, p1-10. 10p.

Native nephrectomy in patients with autosomal dominant polycystic kidney disease in kidney transplant program: long-term single-center experience.

Authors: Navratil P Chalupnik J Merkl T et al.

Source: International urology and nephrology [Int Urol Nephrol] 2025 Feb; Vol. 57 (2), pp. 391-398. Date of Electronic Publication: 2024 Oct 14.

Publication Type: Journal Article

Journal Info: Publisher: Springer Country of Publication: Netherlands NLM ID: 0262521 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1573-2584 (Electronic) Linking ISSN: 03011623 NLM ISO Abbreviation: Int Urol Nephrol Subsets: MEDLINE

Design and investigation of interactions of novel peptide conjugates of purine and pyrimidine derivatives with EGFR and its mutant T790M/L858R: an in silico and laboratory study.

Authors: Hunt HL Goncalves BG Biggs MA et al.

Source: Molecular diversity [Mol Divers] 2024 Dec; Vol. 28 (6), pp. 3683-3711. Date of Electronic Publication: 2024 Jan 19.

Publication Type: Journal Article

Journal Info: Publisher: ESCOM Science Publishers Country of Publication: Netherlands NLM ID: 9516534 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1573-501X (Electronic) Linking ISSN: 13811991 NLM ISO Abbreviation: Mol Divers Subsets: MEDLINE