~/aixsci
200 records · all checked

What the AI was for

Experimental design

Choosing which experiment or measurement to perform next.

21articles
6Structural biology
12Materials & chemistry
3Astronomy

aix-00163

Peptides designed by simulation and machine learning sit at condensate surfaces

simulation surrogateproperty predictioncandidate generationexperimental design

structural-biology · ai-result · Nature Communications · 2026

aix-00144

Machine-learned potentials trained to simulate copper ion conductor Cu7PS6 faster

simulation surrogateexperimental design

materials-chemistry · ai-result · arXiv · 2024

aix-00139

Robot laser-heats thin films while software picks each next heating condition

experimental designclassificationproperty prediction

materials-chemistry · ai-result · arXiv · 2026

aix-00176

Neural network potentials trained by repeatedly checking where models disagree on hydrogen sticking to copper

simulation surrogateexperimental design

materials-chemistry · ai-result · The Journal of Physical Chemistry C · 2023

aix-00178

Machine learning picked catalyst recipes for a loop of 44 lab cycles

property predictionexperimental design

materials-chemistry · ai-result · Nature Communications · 2023

aix-00180

Teaching protein language models to rank mutants from a few dozen lab measurements

property predictionexperimental design

structural-biology · ai-result · Nature Communications · 2024

aix-00126

Pretrained potentials give a structure search a head start in finding atomic arrangements

simulation surrogateexperimental designstructure determination

materials-chemistry · ai-result · arXiv · 2024

aix-00065

Model predicts how fast an enzyme works on a substrate, with uncertainty attached

property predictionexperimental design

structural-biology · ai-result · Briefings in Bioinformatics · 2025

aix-00051

Ultrasound-treated clay bleaches cooking oil, with machine learning picking the settings

property predictionexperimental design

materials-chemistry · ai-supporting · Food Science & Nutrition · 2024

aix-00040

Statistical model of 5,441 perovskite solar cells predicts efficiency and suggests recipes

property predictioncandidate generationexperimental design

materials-chemistry · ai-result · Journal of Chemical Information and Modeling · 2026

aix-00030

Software spotted a nearby supernova and booked a telescope within minutes

classificationexperimental design

astronomy · ai-result · The Astrophysical Journal · 2025

aix-00026

Algorithm picks starting powders and temperatures for making inorganic materials

classificationexperimental design

materials-chemistry · ai-result · Nature Communications · 2023

aix-00024

Machine learning picked which engineered enzymes to build for fatty alcohol production

property predictionclassificationexperimental design

structural-biology · ai-result · Nature Communications · 2021

aix-00018

Telescope targets chosen nightly by a classifier learning from its own spectra

classificationexperimental design

astronomy · ai-result · Publications of the Astronomical Society of Australia · 2025

aix-00017

Neural network picks bright exploding stars from sky survey alerts and books telescope time

classificationexperimental design

astronomy · ai-result · The Astrophysical Journal · 2024

aix-00016

Machine learning picked which shape-memory alloys to make next, round by round

property predictionexperimental design

materials-chemistry · ai-result · Nature Communications · 2016

aix-00012

Machine-learned force model simulates silicon-oxygen structures from glass surfaces to monoxide grains

simulation surrogateexperimental design

materials-chemistry · ai-result · Nature Communications · 2024

aix-00011

A learning algorithm ran a synchrotron beamline to find a phase-change material

experimental designproperty predictionclassification

materials-chemistry · ai-result · Nature Communications · 2020

aix-00010

Robotic lab with machine learning proposes and runs 353 inorganic synthesis experiments

candidate generationproperty predictionclassificationexperimental design

materials-chemistry · ai-result · Nature · 2023

aix-00009

Gaussian process models pick light-sensitive ion channels that reach mammalian cell membranes

property predictionclassificationexperimental design

structural-biology · ai-result · PLoS Computational Biology · 2017

aix-00004

Robot lab and learning agent redesign an enzyme to survive higher temperatures

property predictionclassificationexperimental design

structural-biology · ai-result · Nature Chemical Engineering · 2024