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Daniil A. Boiko
Observed names:
Boiko, Daniil,
Boiko, Daniil A,
Boiko, Daniil A.,
D. A. Boiko,
Daniil A. Boiko,
Daniil Boiko,
Д A БОЙКО
show all 7
Institutions:
Russian Academy of Sciences,
N.D. Zelinsky Institute of Organic Chemistry,
Carnegie Mellon University
Observed institutions:
Russian Academy of Sciences,
Lomonosov Moscow State University,
N.D. Zelinsky Institute of Organic Chemistry,
Carnegie Mellon University
ORCID:
0000-0003-4140-4645
Observed ORCID:
0000-0003-4140-4645
OpenAlex ID:
A5065327102
Autonomous chemical research with large language models
2023
·
Daniil A. Boiko
, Robert MacKnight
, et al.
·
Nature
·
1,031
PDF
Fully Automated Unconstrained Analysis of High-Resolution Mass Spectrometry Data with Machine Learning
2022
·
Daniil A. Boiko
, Konstantin S. Kozlov
, et al.
·
Journal of the American Chemical Society
·
215
Toward Totally Defined Nanocatalysis: Deep Learning Reveals the Extraordinary Activity of Single Pd/C Particles
2022
·
Dmitry B. Eremin
, Alexey S. Galushko
, et al.
·
Journal of the American Chemical Society
·
171
Emergent autonomous scientific research capabilities of large language models
2023
·
Boiko, Daniil A.
, MacKnight, Robert
, et al.
·
arXiv (Cornell University)
·
72
PDF
Time-Resolved Formation and Operation Maps of Pd Catalysts Suggest a Key Role of Single Atom Centers in Cross-Coupling
2023
·
Alexey S. Galushko
, Daniil A. Boiko
, et al.
·
Journal of the American Chemical Society
·
56
Electron microscopy dataset for the recognition of nanoscale ordering effects and location of nanoparticles
2020
·
Daniil A. Boiko
, Evgeniy O. Pentsak
, et al.
·
Scientific Data
·
41
PDF
Connecting chemical and protein sequence space to predict biocatalytic reactions
2025
·
Alexandra E. Paton
, Daniil A. Boiko
, et al.
·
Nature
·
38
PDF
Evidence for “cocktail”-type catalysis in Buchwald–Hartwig reaction. A mechanistic study
2021
·
Darya O. Prima
, Malena Madiyeva
, et al.
·
Catalysis Science & Technology
·
30
Advancing molecular machine learning representations with stereoelectronics-infused molecular graphs
2025
·
Daniil A. Boiko
, Thiago Reschützegger
, et al.
·
Nature Machine Intelligence
·
25
PDF
Deep neural network analysis of nanoparticle ordering to identify defects in layered carbon materials
2021
·
Daniil A. Boiko
, Evgeniy O. Pentsak
, et al.
·
Chemical Science
·
24
PDF
Mechanistic Study of Pd/NHC‐Catalyzed Sonogashira Reaction: Discovery of NHC‐Ethynyl Coupling Process
2020
·
Dmitry B. Eremin
, Daniil A. Boiko
, et al.
·
Chemistry - A European Journal
·
22
PDF
Integration of thermal imaging and neural networks for mechanical strength analysis and fracture prediction in 3D-printed plastic parts
2022
·
Daniil A. Boiko
, Victoria A. Korabelnikova
, et al.
·
Scientific Reports
·
20
PDF
Discovering organic reactions with a machine-learning-powered deciphering of tera-scale mass spectrometry data
2025
·
Konstantin S. Kozlov
, Daniil A. Boiko
, et al.
·
Nature Communications
·
19
Cell Painting for cytotoxicity and mode-of-action analysis in primary human hepatocytes
2026
·
Jessica D. Ewald
, Katherine L. Titterton
, et al.
·
Cell Systems
·
15
Digital biology approach for macroscale studies of biofilm growth and biocide effects with electron microscopy
2023
·
Konstantin S. Kozlov
, Daniil A. Boiko
, et al.
·
Digital Discovery
·
15
PDF
Neural Network Analysis of Electron Microscopy Video Data Reveals the Temperature‐Driven Microphase Dynamics in the Ions/Water System
2021
·
Alexey S. Kashin
, Daniil A. Boiko
, et al.
·
Small
·
15
Rethinking chemical research in the age of large language models
2025
·
Robert MacKnight
, Daniil A. Boiko
, et al.
·
Nature Computational Science
·
14
Deep generative modeling of annotated bacterial biofilm images
2025
·
Angelina A. Holicheva
, Konstantin S. Kozlov
, et al.
·
npj Biofilms and Microbiomes
·
13
PDF
Ten-fold boost of catalytic performance in thiol–yne click reaction enabled by a palladium diketonate complex with a hexafluoroacetylacetonate ligand
2018
·
Dmitry B. Eremin
, Daniil A. Boiko
, et al.
·
Catalysis Science & Technology
·
11
Automated Recognition of Nanoparticles in Electron Microscopy Images of Nanoscale Palladium Catalysts
2022
·
Daniil A. Boiko
, Valentina V. Sulimova
, et al.
·
Nanomaterials
·
9
PDF
Boosting the generality of catalytic systems by the synergetic ligand effect in Pd-catalyzed C-N cross-coupling
2023
·
Nikolay O. Grebennikov
, Daniil A. Boiko
, et al.
·
Journal of Catalysis
·
8
Digitization of molecular complexity with machine learning
2025
·
Andrei S. Tyrin
, Daniil A. Boiko
, et al.
·
Chemical Science
·
7
PDF
Recognition of Molecular Structure of Phosphonium Salts from the Visual Appearance of Material with Deep Learning Can Reveal Subtle Homologs
2024
·
Daniil A. Boiko
, Daria M. Arkhipova
, et al.
·
Small
·
7
Determining the orderliness of carbon materials with nanoparticle imaging and explainable machine learning
2024
·
Mikhail Yu. Kurbakov
, Valentina V. Sulimova
, et al.
·
Nanoscale
·
7
PDF
Sustainable catalysts in a short time: harnessing bacteria for swift palladium nanoparticle production
2025
·
Olga A. Kamanina
, Pavel V. Rybochkin
, et al.
·
Nanoscale
·
6
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Works count:
71
Citation count:
1,940
H-index:
15
I10-index:
19
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