Publicaciones
Publicaciones agradeciendo al NLHPC por el aporte con capacidad de cómputo a sus proyectos de investigación.
2027
Effects of anchoring arms and substituents on Zn(II) phthalocyanine sensitizers in Dye–TiO2 interfaces volume = 256 Artículo de revista
En: Dyes and Pigments, pp. 114119, 2027, ISSN: 0143-7208.
2026
DEM-enabled exploration of spatial inhomogeneities during the cyclic torsional shear of sand Artículo de revista
En: Computers and Geotechnics, vol. 200, pp. 108436, 2026, ISSN: 0266-352X.
A comprehensive genome-scale metabolic model for porcine cells as a tool for process optimization and design in the cultivated meat industry Artículo de revista
En: Future Foods, vol. 14, pp. 101132, 2026, ISSN: 2666-8335.
Ultrafast thermal sintering controls thermal transport in high-entropy alloy nanoparticle junctions volume = 270 Artículo de revista
En: International Journal of Heat and Mass Transfer, pp. 129207, 2026, ISSN: 0017-9310.
Dual-level global sensitivity and seismic fragility analysis of monopile-supported offshore wind turbines via physics-based surrogate modeling volume = 368 Artículo de revista
En: Ocean Engineering, pp. 128314, 2026, ISSN: 0029-8018.
Tuning critical current and vortex behavior via defect dimensions in mesoscopic superconducting thin films volume = 596 Artículo de revista
En: Physics Letters A, pp. 132129, 2026, ISSN: 0375-9601.
Discovery of a novel class of broad-spectrum antivirals targeting the UEV domain of TSG101 in the host ESCRT pathway Artículo de revista
En: European Journal of Medicinal Chemistry, vol. 318, pp. 119162, 2026, ISSN: 0223-5234.
Beyond the catalytic site: Voxilaprevir and Pasireotide as repurposed therapeutics for conformational inhibition of ADAR1 volume = 148 Artículo de revista
En: Journal of Molecular Graphics and Modelling, pp. 109502, 2026, ISSN: 1093-3263.
Long-read RNA sequencing reveals sex-associated isoform distribution in soma and neuropil of the rat hippocampal CA1 ISSN = 2042-6410 Artículo de revista
En: Biology of Sex Differences, 2026.
Enhancing the stability of silicon anodes using polymer binders based on host-guest and hydrogen-bonding interactions: Do small changes in guest tether length matter? volume = 257 Artículo de revista
En: European Polymer Journal, pp. 115056, 2026, ISSN: 0014-3057.
En: Food Chemistry, pp. 150588, 2026, ISSN: 0308-8146.
Spring–neap variability of water column mixing and internal hydraulic control in a Chilean Patagonian channel Artículo de revista
En: Estuarine, Coastal and Shelf Science, vol. 341, pp. 110142, 2026, ISSN: 0272-7714.
Comparative DFT study of supramolecular complexes formed by fullerene C60 with two P-core-modified porphyrins Artículo de revista
En: Computational and Theoretical Chemistry, vol. 1264, pp. 115958, 2026, ISSN: 2210-271X.
First-principles investigation of CuNbS3 and CuTaS3: Promising chalcogenide perovskites for photovoltaic applications volume = 48 Artículo de revista
En: Computational Condensed Matter, pp. e01336, 2026, ISSN: 2352-2143.
Atomistic study of structure and mechanical performance of MgCaZn metallic glasses for biomedical scaffolds volume = 690 Artículo de revista
En: Journal of Non-Crystalline Solids, pp. 124238, 2026, ISSN: 0022-3093.
Structure–property correlations in ester-and carboxyl–functionalized curcuminoids: A combined experimental and theoretical study volume = 253 Artículo de revista
En: Dyes and Pigments, pp. 113847, 2026, ISSN: 0143-7208.
Regioselective Counterion Association Governs Organohalogenochromism in Ferrocenyl Ionic Push-Pull Chromophores volume = 130 Artículo de revista
En: The Journal of Physical Chemistry B, no 40, pp. 10666-10673, 2026, ISSN: 1520-5207.
Prophage ΦESI promotes competitive dominance in the emergent Salmonella serovar Infantis lineage ISSN = 2165-0497 Artículo de revista
En: Microbiology Spectrum, 2026.
Identification of Deformation Mechanisms in Nanocrystalline B2 CuZr ISSN = 1793-6578 Artículo de revista
En: International Journal of Modern Physics B, 2026.
Planar Tetracoordinate Hydrogen Stabilized Within Alkali Metal–Halogen Frameworks volume = 27 Artículo de revista
En: ChemPhysChem, no 18, 2026, ISSN: 1439-7641.
Polarizability in graphene increases nanoscale friction by amplifying interfacial energy corrugation Artículo de revista
En: The Journal of Chemical Physics, vol. 165, no 12, 2026, ISSN: 1089-7690.
GPER and EGFR cross-talk highlight aldosterone-and MR antagonist-induced NO production in cultured endothelial cells volume = 17 Artículo de revista
En: Frontiers in Pharmacology, 2026, ISSN: 1663-9812.
E2(η6–Be6H6) (E=Si–Pb): Doubly Aromatic Inverse-Sandwich Complexes volume = 130 Artículo de revista
En: The Journal of Physical Chemistry A, no 37, pp. 7394-7403, 2026, ISSN: 1520-5215.
STELLAR: A Fragment-Based Docking Workflow for Highly Flexible Long-Chain Biopolymers ISSN = 1549-960X Artículo de revista
En: Journal of Chemical Information and Modeling, 2026.
Attention-Based LSTM Forecasting of O3, NO2, and NO Concentrations in Eastern Santiago, Chile volume = 17 Artículo de revista
En: Atmosphere, no 9, pp. 893, 2026, ISSN: 2073-4433.
Unveiling adsorption mechanisms of emerging pharmaceutical contaminants on graphene oxide via an integrative experimental–theoretical approach volume = 59 Artículo de revista
En: FlatChem, pp. 101116, 2026, ISSN: 2452-2627.
Wetting interfacial diagram for equal-sized binary Lennard-Jones fluid mixtures volume = 165 Artículo de revista
En: The Journal of Chemical Physics, no 10, 2026, ISSN: 1089-7690.
Evolutionary Reorganization of Transcriptomic Architecture Across a UVB Tolerance Gradient in Fish volume = 16 Artículo de revista
En: Ecology and Evolution, no 9, 2026, ISSN: 2045-7758.
En: ZooKeys, pp. 1-18, 2026, ISSN: 1313-2989.
A bilevel model and a column generation heuristic for the transit network design and frequency setting problem with capacity constraints volume = 211 Artículo de revista
En: Transportation Research Part B: Methodological, pp. 103542, 2026, ISSN: 0191-2615.
Surface-functionalization of V2O5 cathodes with azobenzene derivatives: A combined experimental and theoretical study volume = 172 Artículo de revista
En: Journal of Energy Storage, pp. 122905, 2026, ISSN: 2352-152X.
Halide-dependent bonding and electronic structure in mechanochemically synthesized CsNiX3 (X=Cl,Br,I) perovskites volume = 361 Artículo de revista
En: Journal of Solid State Chemistry, pp. 126087, 2026, ISSN: 0022-4596.
Blue shifted push pull Phenalenone dyes: An unconventional behavior in membranes volume = 478 Artículo de revista
En: Journal of Photochemistry and Photobiology A: Chemistry, pp. 117188, 2026, ISSN: 1010-6030.
QM/MM Reveals Coordination Shift behind Early Lanthanide Preference in Methanol Dehydrogenase XoxF volume = 130 Artículo de revista
En: The Journal of Physical Chemistry B, no 36, pp. 9070-9083, 2026, ISSN: 1520-5207.
Angular momentum evolution in the CIELO simulations. I. Temporal evolution of gas–stellar misalignments and baryonic merger timing ISSN = 1432-0746 Artículo de revista
En: Astronomy & Astrophysics, 2026.
Ultra-deep sequencing reveals intra-host diversity and selective constraint in SARS-CoV-2 samples from Chile ISSN = 2045-2322 Artículo de revista
En: Scientific Reports, 2026.
Planar Heptacoordinate Halogens ISSN = 2694-2445 Artículo de revista
En: ACS Physical Chemistry Au, 2026.
The Mahalanobis Distance as a Multivariate Performance Metric for Selecting Physics Parameterizations in Meteorological Simulations volume = 17 Artículo de revista
En: Atmosphere, no 9, pp. 827, 2026, ISSN: 2073-4433.
The selective asymmetric traveling salesman problem with activities and workgroups ISSN = 1572-9338 Artículo de revista
En: Annals of Operations Research, 2026.
Primordial non-Gaussianity—fast simulations and persistent summary statistics volume = 2026 Artículo de revista
En: Journal of Cosmology and Astroparticle Physics, no 08, pp. 051, 2026, ISSN: 1475-7516.
Quantum percolation in honeycomb lattices under random spin-orbit coupling volume = 114 Artículo de revista
En: Physical Review E, no 2, 2026, ISSN: 2470-0053.
Quasi-Keplerian Be-star Disks with Mimicking Viscosity volume = 1008 Artículo de revista
En: The Astrophysical Journal, no 1, pp. 7, 2026, ISSN: 1538-4357.
Structural Determinants of Zn2+ Potentiation of Gingipain B Inhibition of Porphyromonas gingivalis by Compounds With the Benzamidine Group: A Computational Study Artículo de revista
En: Proteins: Structure, Function, and Bioinformatics, 2026, ISSN: 1097-0134.
Experimental, Genomic, and Structural Evidence Supporting Putative PET‐Hydrolases in Thermophilic Bacteria Isolated From Hot Springs in Cajamarca, Peru volume = 15 Artículo de revista
En: MicrobiologyOpen, no 4, 2026, ISSN: 2045-8827.
Synthesis and In Vivo Antifungal Evaluation of3-Acyl-bromoindole Regioisomers: A Multi-Targeting Study on Postharvest Pathogen Control and Molecular Dynamics volume = 15 Artículo de revista
En: Antibiotics, no 8, pp. 801, 2026, ISSN: 2079-6382.
The major June2023 flood event in Central Chile: Hydrometeorological characterization and rain-on-snow contribution ISSN = 1525-7541 Artículo de revista
En: Journal of Hydrometeorology, 2026.
Theoretical characterization of the magnetic properties of vanadium-doped Ti2 C MXenes volume = 13 Artículo de revista
En: 2D Materials, no 3, pp. 035021, 2026, ISSN: 2053-1583.
Intrinsic Flexibility of ADAR1 Destabilizes ZYS-1 Binding: Challenges Inhibitor Design ISSN = 0022-2860 Artículo de revista
En: Journal of Molecular Structure, pp. 147354, 2026.
Effects of anchoring arms and substituents on Zn(II) phthalocyanine sensitizers in Dye–TiO2 interfaces volume = 256 Artículo de revista
En: Dyes and Pigments, pp. 114119, 2027, ISSN: 0143-7208.
Synthesis, Structure, and Reactivity of a Magnesium(0) Complex with a Polarized Mg δ− ─Ca δ+ Bond ISSN = 1521-3773 Artículo de revista
En: Angewandte Chemie International Edition, 2026.
Chemical Profiling and Cheminformatic Insights into Piper Essential Oils as Sustainable Antimicrobial Agents Against Pathogens of Cocoa Crops volume = 31 Artículo de revista
En: Molecules, no 2, pp. 326, 2026, ISSN: 1420-3049.
Scour‐Conditioned Seismic Fragility Analysis of Monopile‐Supported Offshore Wind Turbines ISSN = 1096-9845 Artículo de revista
En: Earthquake Engineering & Structural Dynamics, 2026.
The mass-metallicity relation of bulges volume = 705 Artículo de revista
En: Astronomy & Astrophysics, pp. A87, 2026, ISSN: 1432-0746.
Discovery and Preliminary Characterization of Lactose-Transforming Enzymes in Ewingella americana L47: A Genomic, Biochemical, and In Silico Approach volume = 27 Artículo de revista
En: International Journal of Molecular Sciences, no 2, pp. 1128, 2026, ISSN: 1422-0067.
Electronic Structure Descriptors for the Adsorption of Aromatic Molecules on Metals ISSN = 1520-5002 Artículo de revista
En: Chemistry of Materials, 2026.
The ALMA survey to Resolve exoKuiper belt Substructures (ARKS) volume = 705 Artículo de revista
En: Astronomy & Astrophysics, pp. A203, 2026, ISSN: 1432-0746.
Exploration of the interaction strength at the interface of neutral chalcogen ligands and gold surfaces volume = 16 Artículo de revista
En: RSC Advances, no 5, pp. 4335-4346, 2026, ISSN: 2046-2069.
A Computational Tool and Web Server for the Prediction of Obesity Drugs Artículo de revista
En: Obesity, 2026, ISSN: 1930-739X.
Advancing Ozone Forecasting in High-Altitude Tropical Cities: A WRF-Chem Application for Quito, Ecuador ISSN = 1309-1042 Artículo de revista
En: Atmospheric Pollution Research, pp. 102925, 2026.
Computational modeling of ubiquitin specific protease7 (USP7) complexes with N-benzylpiperidinol derivatives incorporating binding site flexibility volume = 144 Artículo de revista
En: Journal of Molecular Graphics and Modelling, pp. 109272, 2026, ISSN: 1093-3263.
OBE ‐ DB : A Computational Tool and Web Server for the Prediction of Obesity Drugs ISSN = 1930-739X Artículo de revista
En: Obesity, 2026.
Experimental study of shear thinning effects on solitary wave propagation: A Newtonian fluid comparison volume = 348 Artículo de revista
En: Journal of Non-Newtonian Fluid Mechanics, pp. 105560, 2026, ISSN: 0377-0257.
Accurate haplotype-resolved de novo assembly of human genomes with RFhap Artículo de revista
En: 2026.
Evaluation of Planar‐ and Bowl‐Shaped Metallophosphaporphyrins. Inclusion of Steric Effects in P4‐Metalloporphyrins Counterparts volume = 9 Artículo de revista
En: Advanced Theory and Simulations, no 2, 2026, ISSN: 2513-0390.
Integrated experimental and theoretical study of CuO/ZnO nanocomposites for photocatalytic and supercapacitor applications volume = 84 Artículo de revista
En: Surfaces and Interfaces, pp. 108506, 2026, ISSN: 2468-0230.
Structure–property relationships governing metallic glass strength from atomistic simulations volume = 679 Artículo de revista
En: Journal of Non-Crystalline Solids, pp. 124023, 2026, ISSN: 0022-3093.
Positional isomers of π-extended phenolate-based inverted solvatochromic dyes: Shifting the inversion point by relocating the aryl spacer volume = 250 Artículo de revista
En: Dyes and Pigments, pp. 113635, 2026, ISSN: 0143-7208.
Genomic resilience to sequential environmental perturbations in two sympatric costal fish species volume = 216 Artículo de revista
En: Marine Environmental Research, pp. 107893, 2026, ISSN: 0141-1136.
A Multi-Method Antarctic Atmospheric Blocking Dataset (1979–2024) url = https://doi.org/10.5194/essd-2026-55 Artículo de revista
En: 2026.
Superconducting diode effect in a meso-wedge geometry with Abrikosov vortices volume = 9 Artículo de revista
En: SciPost Physics Core, no 1, 2026, ISSN: 2666-9366.
En: Pharmaceuticals, no 3, pp. 381, 2026, ISSN: 1424-8247.
Enhancing Drug Repurposing with Consensus Docking: Discovery of Novel Discoidin Domain Receptor1 Inhibitors volume = 21 Artículo de revista
En: ChemMedChem, no 2, 2026, ISSN: 1860-7187.
Very low-mass stars and their tidal disruption around a stellar mass black hole volume = 371 Artículo de revista
En: Astrophysics and Space Science, no 2, 2026, ISSN: 1572-946X.
New self-consistent theoretical descriptions for mass-loss rates of O-type stars url = https://arxiv.org/abs/2602.16526 Artículo de revista
En: arXiv, 2026.
Isotopic effects in rotational de-excitation of H2CO isotopologues (HDCO and D2CO) by He at low temperatures Artículo de revista
En: Astronomy & Astrophysics, 2026, ISSN: 1432-0746.
Kinetic energy fluctuations and specific heat in generalized ensembles url = https://arxiv.org/abs/2603.02168 Artículo de revista
En: arXiv, 2026.
Coexistence of Uniform and Dimerized Chains in Low-Dimensional NbS3 : Metallic vs Semiconducting Character ISSN = 1520-510X Artículo de revista
En: Inorganic Chemistry, 2026.
Constraints on the odderon amplitude in the CGC framework url = https://arxiv.org/abs/2603.02394 Artículo de revista
En: arXiv, 2026.
Ligand-dependent stability and ORR/OER activity of single-layer metal-organic frameworks Artículo de revista
En: Electrochimica Acta, vol. 558, pp. 148589, 2026, ISSN: 0013-4686.
Tuning gas transport properties via ortho-methyl substitution in spirobi[fluorene]-based polyimides: interplay of rigidity and free volume volume = 349 Artículo de revista
En: Polymer, pp. 129748, 2026, ISSN: 0032-3861.
Ultrafast Cation–Dication Dynamics in Ammonia Borane: H-Migration to Roaming H2 and Reduced H3 + Formation under Strong-Field Ionization volume = 130 Artículo de revista
En: The Journal of Physical Chemistry A, no 9, pp. 1780-1789, 2026, ISSN: 1520-5215.
Kinetic‐Based Macro‐Modeling of the Solar Wind at Large Heliocentric Distances: Kappa Electrons at the Exobase volume = 131 Artículo de revista
En: Journal of Geophysical Research: Space Physics, no 2, 2026, ISSN: 2169-9402.
Metal-loaded outflows in sub-Milky Way galaxies in the CIELO simulations volume = 706 Artículo de revista
En: Astronomy & Astrophysics, pp. A274, 2026, ISSN: 1432-0746.
Exclusive photoproduction of χcγ pairs in the small-x kinematics Artículo de revista
En: Physical Review D, vol. 113, no 3, 2026, ISSN: 2470-0029.
Synthesis of2-Aryl-4-aminoquinazolines: Design, Molecular Docking, and In Vitro Assessment of Antibacterial and Cytotoxic Potential volume = 27 Artículo de revista
En: International Journal of Molecular Sciences, no 6, pp. 2529, 2026, ISSN: 1422-0067.
Tunable Nd3+ dimer luminescent molecular thermometer via Stark sublevels ISSN = 2052-1553 Artículo de revista
En: Inorganic Chemistry Frontiers, 2026.
Planar tetracoordinate nitrogen in main-group cationic clusters ISSN = 1463-9084 Artículo de revista
En: Physical Chemistry Chemical Physics, 2026.
Blue shifted push pull Phenalenone dyes: An unconventional behavior in membranes volume = 478 Artículo de revista
En: Journal of Photochemistry and Photobiology A: Chemistry, pp. 117188, 2026, ISSN: 1010-6030.
From local to global or semilocal aromaticity: singlet–triplet switching in porphyrin tapes ISSN = 1364-548X Artículo de revista
En: Chemical Communications, 2026.
Ab initio study of manufacturing routes of the Cantor high entropy alloys: Magnetic and thermodynamic properties volume = 46 Artículo de revista
En: Computational Condensed Matter, pp. e01256, 2026, ISSN: 2352-2143.
Spin-orbit coupled periodic Anderson model: Kondo-Dirac semimetal and orbital-selective antiferromagnetic semimetal Artículo de revista
En: Physical Review B, vol. 113, no 8, 2026, ISSN: 2469-9969.
MPNN-guided redesign of PET hydrolases with enhanced catalytic activity below the PET glass transition temperature Artículo de revista
En: 2026.
A Mechanistic, Architecture-Dependent Study Combining Experiments and Molecular Dynamics to Explain AMP Release from GO–PEI Coatings volume = 13 Artículo de revista
En: Bioengineering, no 3, pp. 341, 2026, ISSN: 2306-5354.
Electrostatic and geometric control of hydride transfer stereoselectivity in bridged pterins: A computational study volume = 1260 Artículo de revista
En: Computational and Theoretical Chemistry, pp. 115771, 2026, ISSN: 2210-271X.
Mapping the morphology and thermal stability of AgCo nanoalloys: Composition-driven phase segregation and functional implications volume = 1061 Artículo de revista
En: Journal of Alloys and Compounds, pp. 187518, 2026, ISSN: 0925-8388.