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Category:All HeadlinesWorld & GeopoliticsMarkets & EconomyTech & AIPoliticsSearch results for: "High-throughput computati" (30 stories)

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Accurate and efficient protocols for high-throughput first-principles materials simulations
Lead StoryNaturegeneral
Apr 29

Accurate and efficient protocols for high-throughput first-principles materials simulations

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5fX3hpMUdmcmxpaE44NTg3bEVIVlRKczBzVTJDQmJ3Ry13ZkdHS0swVWJwaWVkWnpVRXVhRDljemxFT3lieXdpeHZCSzVqSDlLaEtPQVFRTHpYOWpYbmMw?oc=5" target="_blank">Accurate and efficient protocols for high-throughput first-principles materials simulations</a>  <font color="#6f6f6f">Nature</font>

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Search Results for "High-throughput computati"

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29 stories displayed
High-throughput computation of electric polarization in solids via Berry flux diagonalization
Naturegeneral

High-throughput computation of electric polarization in solids via Berry flux diagonalization

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5MYVFCQ0RxVnd4MlEzU2ZwMzJtLWh2Y2JsTHhZaDRDdC1YbjJwMXp4VGl1UEIxUTVWMmJ4TXlvM3VOdHlSNjZmUXc0WXVsZnZ1U0IzTy1lQjdqRG92cEFj?oc=5" target="_blank">High-throughput computation of electric polarization in solids via Berry flux diagonalization</a>  <font color="#6f6f6f">Nature</font>

High-Throughput, Label-Free and Slide-Free Histological Imaging by Computational Microscopy and Unsupervised Learning
Wiley & Sonsworld

High-Throughput, Label-Free and Slide-Free Histological Imaging by Computational Microscopy and Unsupervised Learning

<a href="https://news.google.com/rss/articles/CBMie0FVX3lxTFAxMHlPTG9GelVmc0YyZERQLTZOdHVuUUMtNWV3MDNUSHozN2dXUVA3Z2p5MkxiRzNrVzZCNU4wR1lrZjgtYzJkMF9WLUU2bEtSbk4ydndNMllDLUtYSHdsWmZBOFJHNUJRZFJpM3hFWlduSnVqX0JoMmVFSQ?oc=5" target="_blank">High-Throughput, Label-Free and Slide-Free Histological Imaging by Computational Microscopy and Unsupervised Learning</a>  <font color="#6f6f6f">Wiley & Sons</font>

Brieflow: an integrated computational pipeline for high-throughput analysis of optical pooled screening data
Naturegeneral

Brieflow: an integrated computational pipeline for high-throughput analysis of optical pooled screening data

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTFBBVkxpbXJ3ODRLTW4tUjJYUlEyQ3lERHVvU2ExbXBwb2ZLbWpDMlFkLWRTRkNNdmRoQlVXQ1BRWVE4SVVDSy1lMzFSYUw4WU5FOTNDX29VWkd5ZzMzRktV?oc=5" target="_blank">Brieflow: an integrated computational pipeline for high-throughput analysis of optical pooled screening data</a>  <font color="#6f6f6f">Nature</font>

A Unified preprocessing framework for high-throughput diffraction pattern analysis | npj Computational Materials
Natureworld

A Unified preprocessing framework for high-throughput diffraction pattern analysis | npj Computational Materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE9uU2tCenFfRVZmZWw3cXJNdG5XQVlsUVZpV3NhUHVSZnQwVTVHYXBRUVBvSWhPZk4zYl9KUjhmd211eTFZa1k3Ry1RWEo3b1NpWWFYay1CaWV3cE1ZQjBF?oc=5" target="_blank">A Unified preprocessing framework for high-throughput diffraction pattern analysis | npj Computational Materials</a>  <font color="#6f6f6f">Nature</font>

Automated phase mapping of high-throughput X-ray diffraction data encoded with domain-specific materials science knowledge
Naturetech

Automated phase mapping of high-throughput X-ray diffraction data encoded with domain-specific materials science knowledge

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5nLUVTd2hFTllvcVlqdkY1YW1GT3BldEp5ekFwdHdjYW9rQzg3Tl95VlBrQkpZREVrQ2t6Y19BRmxSb2MyZU9oaFlJd1R0U1hYSlEwVkVLblZhT3FPVk1J?oc=5" target="_blank">Automated phase mapping of high-throughput X-ray diffraction data encoded with domain-specific materials science knowledge</a>  <font color="#6f6f6f">Nature</font>

Computationally accelerated experimental materials characterization—drawing inspiration from high-throughput simulation workflows
Naturegeneral

Computationally accelerated experimental materials characterization—drawing inspiration from high-throughput simulation workflows

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE45RHVBZ1hsMDFKNXhRRDhnMWxPWG52WU5BMFdGSERUY1lVUzVPUVdQald1QTd4SXpSbXQ4REZvS2ttWlhuQVZObHNUTmNSM3AzWHB5UFZlMnktaWNJMTQ4?oc=5" target="_blank">Computationally accelerated experimental materials characterization—drawing inspiration from high-throughput simulation workflows</a>  <font color="#6f6f6f">Nature</font>

High-throughput alloy and process design for metal additive manufacturing | npj Computational Materials
Naturegeneral

High-throughput alloy and process design for metal additive manufacturing | npj Computational Materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5saUo1a1BQSGZGODBhWUFmYk5zUkpQVlNJN29yT0czejRRWXh2X1h3ODJxOEJ4NUF4cnl0bjNpMDlzQlNqX1ZwblFtYWlZQlBmQWdGUE42eW1FclFQLVdr?oc=5" target="_blank">High-throughput alloy and process design for metal additive manufacturing | npj Computational Materials</a>  <font color="#6f6f6f">Nature</font>

Molecular descriptors for high-throughput virtual screening of fluorescence emitters with inverted singlet-triplet energy gaps
Naturegeneral

Molecular descriptors for high-throughput virtual screening of fluorescence emitters with inverted singlet-triplet energy gaps

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE9sVExCTW85Q09HcXdEbC1tSkRUeG5sUHZOV1V6aGNOazZER2dMeFdUeEhOLUNJWFRlWWtGeWxjMTB1WFB3b1IxaXh4OG9TVGZDOXZENWtSRjdHV1VKc1pj?oc=5" target="_blank">Molecular descriptors for high-throughput virtual screening of fluorescence emitters with inverted singlet-triplet energy gaps</a>  <font color="#6f6f6f">Nature</font>

Absorption versus adsorption: high-throughput computation of impurities in 2D materials
Naturegeneral

Absorption versus adsorption: high-throughput computation of impurities in 2D materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE1QT1hVQ0kzY2xBNFFKUHVGQlh1RlhqNkdycm0zdm9UdlZWNWlQcmplUEV6NUVmMmVSS04telhIOUowZFBqSjIzU01sdkUtekgxZTJSRDlQeE1xakR5amJv?oc=5" target="_blank">Absorption versus adsorption: high-throughput computation of impurities in 2D materials</a>  <font color="#6f6f6f">Nature</font>

Drawing boundaries between feasible and unfeasible zeolite intergrowths using high-throughput computational screening with synthesis validation
Natureworld

Drawing boundaries between feasible and unfeasible zeolite intergrowths using high-throughput computational screening with synthesis validation

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTFBEZlljTjZEelNtTk5Ka0ZPZFRiVE9LVHJ5czVYeGpfb1kxay1aVnhGaDZ4UXlKOWQ5QnUtX2J2cDRZTy0xSnhrcl9aZER1UE5rTFU1ZGNQMzVBQ2tTLTMw?oc=5" target="_blank">Drawing boundaries between feasible and unfeasible zeolite intergrowths using high-throughput computational screening with synthesis validation</a>  <font color="#6f6f6f">Nature</font>

High-throughput computational analysis of kinetic barriers to ring-closing depolymerization for aliphatic polycarbonates
Naturegeneral

High-throughput computational analysis of kinetic barriers to ring-closing depolymerization for aliphatic polycarbonates

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE9zTzBXVXRlRHppaldnTGlSRXhhUWZBV3d6d3R3VS05ekQxTjVJdmEyWG9oUjAtdlUwNW9DcmQ5d293WndOcnAwcEo2OWZTYmtBUmI1bnJmODFtdk1Ganp3?oc=5" target="_blank">High-throughput computational analysis of kinetic barriers to ring-closing depolymerization for aliphatic polycarbonates</a>  <font color="#6f6f6f">Nature</font>

Machine learning and high-throughput computational guided development of high temperature oxidation-resisting Ni-Co-Cr-Al-Fe based high-entropy alloys
Naturegeneral

Machine learning and high-throughput computational guided development of high temperature oxidation-resisting Ni-Co-Cr-Al-Fe based high-entropy alloys

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5GcHZtSHBSRzdjOXZmLVJoeEU0MHY2Mk10MkN4UXlqanRsbXpVb3BNRllBNzdhdzNwbUt6Yld0V2RuaGNRZ2p5eEpPQXloY1BsWG14NDI5dGgwT0Z6a0Vv?oc=5" target="_blank">Machine learning and high-throughput computational guided development of high temperature oxidation-resisting Ni-Co-Cr-Al-Fe based high-entropy alloys</a>  <font color="#6f6f6f">Nature</font>

High-throughput and data-driven machine learning techniques for discovering high-entropy alloys
Naturetech

High-throughput and data-driven machine learning techniques for discovering high-entropy alloys

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE9LajJPSDRROUMyRmJBZjBodW5RcTRlc0NjaGYyUlRmQVY4clNucHYydExaUW1nZnVCTXVianBmN21STHBIdS1WZkJZclpOTDdObFNqOS0yUXR1YW1SRDNr?oc=5" target="_blank">High-throughput and data-driven machine learning techniques for discovering high-entropy alloys</a>  <font color="#6f6f6f">Nature</font>

High-throughput discovery of organic cages and catenanes using computational screening fused with robotic synthesis
Naturegeneral

High-throughput discovery of organic cages and catenanes using computational screening fused with robotic synthesis

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE05aFc2WkgzSzhYQmgzc0FsZEVybHBpNVJ4RXJZdVpjdGNESjd3Y3hZcGpIVWxkeTJuakRyNXZ1Y0ZVNXRGUlllb2ttQnFLamhjSkwxOXpmbGpReVFwTXVz?oc=5" target="_blank">High-throughput discovery of organic cages and catenanes using computational screening fused with robotic synthesis</a>  <font color="#6f6f6f">Nature</font>

High-throughput computation and structure prototype analysis for two-dimensional ferromagnetic materials
Naturegeneral

High-throughput computation and structure prototype analysis for two-dimensional ferromagnetic materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5zWHNZR3Q1WU1ObGx4cWJuRWxkb3l6VHNHWHZhTGkxMXd6Z2sxaThNNUJOZkQwUkJjOC0tTXJobGRtMzFhWEhJS3BTOU5vaVl3WHMtOC1HYUNwSVdoR1pF?oc=5" target="_blank">High-throughput computation and structure prototype analysis for two-dimensional ferromagnetic materials</a>  <font color="#6f6f6f">Nature</font>

A multi-fidelity machine learning approach to high throughput materials screening
Naturegeneral

A multi-fidelity machine learning approach to high throughput materials screening

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE1HWDN5REQ3Q0xwZ0huemVqenU1cnJSMGFFYUJqU1pTR2Y0ek1XdFl6ZXpSX2tzdWUyV0VGSmFldUxWbUJyNWZDUDJGN1hvX2NzaGZXQnp4QXlaZ2luem1Z?oc=5" target="_blank">A multi-fidelity machine learning approach to high throughput materials screening</a>  <font color="#6f6f6f">Nature</font>

Bayesian optimization with experimental failure for high-throughput materials growth
Naturetech

Bayesian optimization with experimental failure for high-throughput materials growth

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5kOGxxX244bUpUbEpJS0xncmhmU1pqSE5VdVdGcDBEc3dobVpDZ09pUjFJcEFtQXg5c3lERjJUSVUzdGZmdnRJeEgwSThUUjdQS3lpdFEzeXJ1d1NwLTlB?oc=5" target="_blank">Bayesian optimization with experimental failure for high-throughput materials growth</a>  <font color="#6f6f6f">Nature</font>

High-throughput materials exploration system for the anomalous Hall effect using combinatorial experiments and machine learning | npj Computational Materials
Naturegeneral

High-throughput materials exploration system for the anomalous Hall effect using combinatorial experiments and machine learning | npj Computational Materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE1jVWhtTjFkTUd0c2JKaUFWVWt6djN1aXN4X0taSTlKZ2RUUVFiLVc1LU9pSzlFN3FQV0Z6MWxPN2d3dnNZU0YtMnk0TktxdDJEaVpuVENoYWJYRTlBTFVR?oc=5" target="_blank">High-throughput materials exploration system for the anomalous Hall effect using combinatorial experiments and machine learning | npj Computational Materials</a>  <font color="#6f6f6f">Nature</font>

High-throughput property-driven generative design of functional organic molecules
Natureworld

High-throughput property-driven generative design of functional organic molecules

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE5pZGo0ZEtMeGxjWlhoRGVZMzgwOVFKYmpWQ3ZncW5EUlB0TGU1dFZ0UGFXeXluRDZZc1R5MlV4cndlUGFLRGFteTRQa2lCUFQzRmxJajNoM1NrUUR4aUhR?oc=5" target="_blank">High-throughput property-driven generative design of functional organic molecules</a>  <font color="#6f6f6f">Nature</font>

High-throughput screening of 2D materials identifies p -type monolayer WS
Naturegeneral

High-throughput screening of 2D materials identifies p -type monolayer WS

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE1WNU9XN2I1VFJMa3BTOE5GWExwU1F3bWVWYmx1RlZMS0VYNmZrUGJ4bWFucWxxV3J6c085X1RSd3Fkcjd6TEVpYWpfbmFQejdGTW5uRW1oYVd3SURFZEVv?oc=5" target="_blank">High-throughput screening of 2D materials identifies p -type monolayer WS</a>  <font color="#6f6f6f">Nature</font>

High-throughput computation of Raman spectra from first principles
Naturegeneral

High-throughput computation of Raman spectra from first principles

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE83Qmg3X3l2WVAxVHdZOERjRWY0Sk9nZnJhRmNIRmlxWUVNdnIxNDJVM3hwazYyVEZGZ3lrZmZvS2FUZ2RYb2ktN0FMVkFiWWJCRXYzOVlUMnJ1QUVqNF9F?oc=5" target="_blank">High-throughput computation of Raman spectra from first principles</a>  <font color="#6f6f6f">Nature</font>

Integrating stability metrics with high-throughput computational screening of metal–organic frameworks for CO
Naturegeneral

Integrating stability metrics with high-throughput computational screening of metal–organic frameworks for CO

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE0xXzExaHNCdF9RSEYwZXdOQTlZT0M3VHBhZXFyN0EwSWcyTUN2Z1paaDhnNEcyMHoxdGxuc0NhQzY2N285dWZzRURrZlJLVzJWTTliZ1hkcHRiU0I5Zldj?oc=5" target="_blank">Integrating stability metrics with high-throughput computational screening of metal–organic frameworks for CO</a>  <font color="#6f6f6f">Nature</font>

High-throughput discovery of perturbation-induced topological magnons
Naturegeneral

High-throughput discovery of perturbation-induced topological magnons

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTFBmdk9yN0tiUllBbnk5aU9tN1JkZ2prekkyZVh3Z29rdVNfaWNzazhkN251STBKVDMwTGNnengxc2dnTXV5VzNfV3dUdGRIZF82SHNJTG1kMWJEVDc3Sl9B?oc=5" target="_blank">High-throughput discovery of perturbation-induced topological magnons</a>  <font color="#6f6f6f">Nature</font>

Two-dimensional ferroelectrics from high throughput computational screening | npj Computational Materials
Naturegeneral

Two-dimensional ferroelectrics from high throughput computational screening | npj Computational Materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE9xUGluUEt2RlJqSzExTFMxMEZMbnhRbGdqTEhCckhzQkFfa0o4SjRUbndYbHV0TmFSVWRWTXp2ODlHelkxTC05TldxRlA4d2dNN2Y2R016bnJRN09OQWJ3?oc=5" target="_blank">Two-dimensional ferroelectrics from high throughput computational screening | npj Computational Materials</a>  <font color="#6f6f6f">Nature</font>

Crystallography companion agent for high-throughput materials discovery
Naturegeneral

Crystallography companion agent for high-throughput materials discovery

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTFA5VXRNQWxTZ240UnZETGx2UDJhYnIwRHVmYzl1b3hqaE93MmQ5MEdCNkxNam9rWnRXNjJ6ekFWNERSRXFFY1FfOExDeElMS0RPQTk1WDRiaVVRUlZHWnJV?oc=5" target="_blank">Crystallography companion agent for high-throughput materials discovery</a>  <font color="#6f6f6f">Nature</font>

The high-throughput highway to computational materials design
Naturegeneral

The high-throughput highway to computational materials design

<a href="https://news.google.com/rss/articles/CBMiUkFVX3lxTE5ramlhM2RPNUdJcVhTT3JfUXphaFRhSDR5MkhHRGlBTC1XbFRFYnBLNlhZcHhjZVpieVZtVUlXdF8weHJ1OE05WjRqbURHdTJ0R2c?oc=5" target="_blank">The high-throughput highway to computational materials design</a>  <font color="#6f6f6f">Nature</font>

A computational framework to integrate high-throughput ‘-omics’ datasets for the identification of potential mechanistic links
Naturegeneral

A computational framework to integrate high-throughput ‘-omics’ datasets for the identification of potential mechanistic links

<a href="https://news.google.com/rss/articles/CBMiXkFVX3lxTE1wdnlVWmxpRWRpOGlkV0hXaEhUM0NXSVRtYTZKYTJqbHBMVkowa0NrSTYtZUc3ZzZ4YVFXZmxVY3AxOGZVbUVTUjBrT1ZEV0gzU0ttRXVMYm5EdjRqblE?oc=5" target="_blank">A computational framework to integrate high-throughput ‘-omics’ datasets for the identification of potential mechanistic links</a>  <font color="#6f6f6f">Nature</font>

A high-throughput screening and computation platform for identifying synthetic promoters with enhanced cell-state specificity (SPECS)
Naturegeneral

A high-throughput screening and computation platform for identifying synthetic promoters with enhanced cell-state specificity (SPECS)

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTFBUMHEzcVRDSzJzN1pKeXNYTU8wSUUyaUNGMEZ1Y19jNF9aNGRtYXlKeE9vVkhFUnppTHdiclBoc3BRX29JVnRYN1NiYUxQeHF0YUVOTXMtdDdYb05na0d3?oc=5" target="_blank">A high-throughput screening and computation platform for identifying synthetic promoters with enhanced cell-state specificity (SPECS)</a>  <font color="#6f6f6f">Nature</font>

Machine learning guided high-throughput search of non-oxide garnets | npj Computational Materials
Naturegeneral

Machine learning guided high-throughput search of non-oxide garnets | npj Computational Materials

<a href="https://news.google.com/rss/articles/CBMiX0FVX3lxTE8tYkMzTmhBbmJncGNuUDg4NnlvQjR3czBoVTdIMm5VVnAwbWtod3VFcTFkYXpUSTlhT1RjQjQzR0NwMnRpTXV3ckV2UmlnejhlS1pSbUFkUE90U29ITmI0?oc=5" target="_blank">Machine learning guided high-throughput search of non-oxide garnets | npj Computational Materials</a>  <font color="#6f6f6f">Nature</font>

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