A workflow for deriving chemical entities from crystallographic data and its application to the Crystallography Open Database A Vaitkus, A Merkys, T Sander, M Quirós, PA Thiessen, EE Bolton, ... Journal of Cheminformatics 15 (1), 1-15, 2023 | 11 | 2023 |
A workshop on the functional impact of glycans and their curation K Martinez, J Agirre, Y Akune, KF Aoki-Kinoshita, C Arighi, KB Axelsen, ... GLYCOBIOLOGY 33 (11), 1069-1069, 2023 | | 2023 |
Adding open spectral data to MassBank and PubChem using open source tools to support non-targeted exposomics of mixtures A Elapavalore, T Kondić, RR Singh, BA Shoemaker, PA Thiessen, ... Environmental Science: Processes & Impacts 25 (11), 1788-1801, 2023 | 3 | 2023 |
An overview of the PubChem BioAssay resource Y Wang, E Bolton, S Dracheva, K Karapetyan, BA Shoemaker, TO Suzek, ... Nucleic acids research 38 (suppl_1), D255-D266, 2010 | 342 | 2010 |
An update on PUG-REST: RESTful interface for programmatic access to PubChem S Kim, PA Thiessen, T Cheng, B Yu, EE Bolton Nucleic acids research 46 (W1), W563-W570, 2018 | 100 | 2018 |
Assessment of conformational ensemble sizes necessary for specific resolutions of coverage of conformational space YV Borodina, E Bolton, F Fontaine, SH Bryant Journal of chemical information and modeling 47 (4), 1428-1437, 2007 | 31 | 2007 |
Automated annotation of chemical names in the literature with tunable accuracy JD Zhang, LY Geer, EE Bolton, SH Bryant Journal of cheminformatics 3, 1-10, 2011 | 4 | 2011 |
BioHackathon 2015: Semantics of data for life sciences and RA Vos, T Katayama, H Mishima, S Kawano, S Kawashima, JD Kim, ... | | |
BioHackathon 2015: Semantics of data for life sciences and reproducible research RA Vos, T Katayama, H Mishima, S Kawano, S Kawashima, JD Kim, ... F1000Research 9, 2020 | 8 | 2020 |
BioHackJP 2023 Report R4: integration of glyco data with chemo-, geno-, lipid-omics and pathway data KF Aoki-Kinoshita, E Bolton, I Yamada, A Fujita, M Matsubara, J Bolleman, ... BioHackrXiv, 2023 | | 2023 |
Biologics information in PubChem J Zhang, P Thiessen, T Cheng, B Shoemaker, E Bolton, N O'Boyle, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019 | | 2019 |
Bridging Chemical and Biological Information: Public Knowledge Spaces PA Thiessen, WD Ihlenfeldt, EE Bolton, SH Bryant Computational Approaches in Cheminformatics and Bioinformatics, 1-24, 2011 | | 2011 |
Bridging glycoinformatics and cheminformatics: integration efforts between GlyCosmos and PubChem T Cheng, T Ono, M Shiota, I Yamada, KF Aoki-Kinoshita, EE Bolton Glycobiology 33 (6), 454-463, 2023 | 2 | 2023 |
Can Small Molecules Provide Clues on Disease Progression in Cerebrospinal Fluid from Mild Cognitive Impairment and Alzheimer's Disease Patients? A Mary, C Venegas, T Cheng, L Zaslavsky, EE Bolton, MT Heneka, ... Environmental Science & Technology 58 (9), 4181-4192, 2024 | | 2024 |
Can Small Molecules Provide Clues on Disease Progression in Cerebrospinal Fluid from Mild Cognitive Impairment and Alzheimer’s Disease Patients? BT Andújar, A Mary, C Venegas, T Cheng, L Zaslavsky, EE Bolton, ... Environmental Science & Technology 58 (9), 4181, 2024 | 1 | 2024 |
Can Small Molecules Provide Clues on Disease Progression in Cerebrospinal Fluid from Mild Cognitive Impairment and Alzheimer’s Disease Patients? B Talavera Andújar, A Mary, C Venegas, T Cheng, L Zaslavsky, EE Bolton, ... Environmental Science & Technology 58 (9), 4181-4192, 2024 | | 2024 |
CAS common chemistry in 2021: expanding access to trusted chemical information for the scientific community A Jacobs, D Williams, K Hickey, N Patrick, AJ Williams, S Chalk, ... Journal of Chemical Information and Modeling 62 (11), 2737-2743, 2022 | 19 | 2022 |
Cataloging natural sialic acids and other nonulosonic acids (NulOs), and their representation using the Symbol Nomenclature for Glycans AL Lewis, P Toukach, E Bolton, X Chen, M Frank, T Lütteke, Y Knirel, ... Glycobiology 33 (2), 99-103, 2023 | 5 | 2023 |
Caution! Normalization can be hazardous to your data health E Bolton ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 254, 2017 | | 2017 |
Challenges in big data chemistry using publicly available chemical information S Kim, G Fu, VD Hähnke, L Han, B Yu, L Geer, B Shoemaker, A Gindulyte, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 250, 2015 | | 2015 |