Publicaciones
Publicaciones agradeciendo al NLHPC por el aporte con capacidad de cómputo a sus proyectos de investigación.
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.
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.
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.
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.
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.
Atmospheric River‐Cyclone Events Disrupting an Antarctic Peninsula Field Campaign: Dynamics, Mesoscale Wind Amplification, and Long‐Term Context volume = 131 Artículo de revista
En: Journal of Geophysical Research: Atmospheres, no 16, 2026, ISSN: 2169-8996.
Unraveling the Molecular Basis of NSD3 Allosteric Activation Driven by Nucleosome Binding: A Multiscale MD and QM/MM Approach ISSN = 1549-960X Artículo de revista
En: Journal of Chemical Information and Modeling, 2026.
Fitting and validation of a hybrid interatomic potential for modeling Fe50−XMn30Co10Cr10BX (x = 5 and 7 at.%) compositionally complex alloys Artículo de revista
En: Computational Materials Science, vol. 273, pp. 114946, 2026, ISSN: 0927-0256.
Dynamic spectra of type III radio emissions from particle-in-cell simulations Artículo de revista
En: Astronomy & Astrophysics, vol. 712, pp. L11, 2026, ISSN: 1432-0746.
Anti-auxin treatment and co-expression networks reveal auxin involvement in the transition to ripening in sweet cherry fruits volume = 237 Artículo de revista
En: Plant Physiology and Biochemistry, pp. 111535, 2026, ISSN: 0981-9428.
Long-term road traffic source contribution to ambient NOx, PM10 and PM2.5 volume = 17 Artículo de revista
En: Atmospheric Pollution Research, no 8, pp. 103085, 2026, ISSN: 1309-1042.
Role of oceanic biogenic emissions of dimethyl sulfide in air sulfur chemistry along the southeastern Pacific Chilean coast volume = 17 Artículo de revista
En: Atmospheric Pollution Research, no 8, pp. 103089, 2026, ISSN: 1309-1042.
Modeling wave-induced sediment transport and morphodynamic response in a bar-built estuary volume = 210 Artículo de revista
En: Coastal Engineering, pp. 105056, 2026, ISSN: 0378-3839.
Indoor and outdoor PM2.5 concentrations, sources and their influencing factors in homes and apartments in Santiago, Chile volume = 379 Artículo de revista
En: Atmospheric Environment, pp. 122070, 2026, ISSN: 1352-2310.
The Metallophilicity Phenomenon: The Interplay of Steric, Orbital, Dispersion, and Electronic Correlation Effects in Closed-Shell Metal–Metal Contacts ISSN = 1520-510X Artículo de revista
En: Inorganic Chemistry, 2026.
Impact of heat flux and suprathermal electrons on steady-state solar wind modelling with Icarus: Insights from Parker Solar Probe observations Artículo de revista
En: Astronomy & Astrophysics, vol. 711, pp. A145, 2026, ISSN: 1432-0746.
Hybrid Simulations of the Proton Beam Instabilities in the Young Solar Wind: The Formation of Hammerhead-like Distributions Artículo de revista
En: The Astrophysical Journal, vol. 1005, no 2, pp. 219, 2026, ISSN: 1538-4357.
Photoproduction of the Quarkonia Pairs in the CGC Framework volume = 9 Artículo de revista
En: Particles, no 3, pp. 74, 2026, ISSN: 2571-712X.
Collective dynamics of confined nanoparticles in nanochannel flow ISSN = 1029-0435 Artículo de revista
En: Molecular Simulation, pp. 1-9, 2026.
The heartbeat of stellar halos: Insights from the stellar halo mass-metallicity relation volume = 711 Artículo de revista
En: Astronomy & Astrophysics, pp. A174, 2026, ISSN: 1432-0746.
Geometric controls on slip distribution and segmentation of the largest megathrust earthquakes volume = 135 Artículo de revista
En: Journal of Earth System Science, no 3, 2026, ISSN: 0973-774X.
Formic Acid: A Key Promoter for a Mild Polyamide-6 Depolymerization Approach ISSN = 1520-5835 Artículo de revista
En: Macromolecules, 2026.
En: The Journal of Organic Chemistry, 2026.
Reactivity of Au2Pt2 clusters supported on TiC (001): Insights into ammonia–borane activation and hydrogen release volume = 250 Artículo de revista
En: International Journal of Hydrogen Energy, pp. 155903, 2026, ISSN: 0360-3199.
Wee1-targeting inhibitors: From virtual screening to lead discovery Artículo de revista
En: Bioorganic & Medicinal Chemistry, vol. 138, pp. 118645, 2026, ISSN: 0968-0896.
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.
Structure-based virtual screening for selective connexin hemichannel blockers: a historical perspective on the discovery of a small organic inhibitor Artículo de revista
En: Frontiers in Pharmacology, vol. 17, 2026, ISSN: 1663-9812.
Inverse determination of light-matter coupling in disordered systems from transmittance spectra volume = 113 Artículo de revista
En: Physical Review B, no 21, 2026, ISSN: 2469-9969.
Real-Space Topology and Charge Order in the Haldane-Holstein Model volume = 136 Artículo de revista
En: Physical Review Letters, no 25, 2026, ISSN: 1079-7114.
The geometry of meaning: perfect spacetime representations of hierarchical structures volume = 141 Artículo de revista
En: The European Physical Journal Plus, no 6, 2026, ISSN: 2190-5444.
Phytochemical Profiling of Sticta caulescens De Not.: Green Extraction and Multiscale Chemotaxonomic Analysis volume = 15 Artículo de revista
En: Plants, no 11, pp. 1761, 2026, ISSN: 2223-7747.
Unpacking the relational turn in sustainability science: mapping trends and networks volume = 22 Artículo de revista
En: Sustainability: Science, Practice and Policy, no 1, 2026, ISSN: 1548-7733.
Thermal Stability and Structural Evolution of Li-Mg Alloys Through Atomistic Simulations volume = 16 Artículo de revista
En: Crystals, no 6, pp. 398, 2026, ISSN: 2073-4352.
Reconstructing chemical enrichment pathways in disc galaxies. A phylogenetic approach ISSN = 1432-0746 Artículo de revista
En: Astronomy & Astrophysics, 2026.
Energy Landscapes and Tunable Electronic Properties of Polar and Non-Polar SiC Nanofilms ISSN = 1361-648X Artículo de revista
En: Journal of Physics: Condensed Matter, 2026.
Atomic-scale control of domain wall motion in pristine and defective Fe nanowires with Spin-Lattice Dynamics volume = 11 Artículo de revista
En: Journal of Science: Advanced Materials and Devices, no 2, pp. 101166, 2026, ISSN: 2468-2179.
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.
Very low-mass stars and their tidal disruption around a stellar mass black hole Artículo de revista
En: Astrophysics and Space Science, vol. 371, no 2, 2026, ISSN: 1572-946X.