14 examples of how LLMs can transform materials science and chemistry: a reflection on a large language model hackathon
Large-language models (LLMs) such as GPT-4 caught the interest of many scientists.
Recent studies suggested that these models could be useful in chemistry and materials …
Recent studies suggested that these models could be useful in chemistry and materials …
The unmapped chemical complexity of our diet
Our understanding of how diet affects health is limited to 150 key nutritional components that
are tracked and catalogued by the United States Department of Agriculture and other …
are tracked and catalogued by the United States Department of Agriculture and other …
PubChem in 2021: new data content and improved web interfaces
Abstract PubChem (https://pubchem. ncbi. nlm. nih. gov) is a popular chemical information
resource that serves the scientific community as well as the general public, with millions of …
resource that serves the scientific community as well as the general public, with millions of …
PubChem 2019 update: improved access to chemical data
Abstract PubChem (https://pubchem. ncbi. nlm. nih. gov) is a key chemical information
resource for the biomedical research community. Substantial improvements were made in …
resource for the biomedical research community. Substantial improvements were made in …
PubChem 2023 update
S Kim, J Chen, T Cheng, A Gindulyte, J He… - Nucleic acids …, 2023 - academic.oup.com
Abstract PubChem (https://pubchem. ncbi. nlm. nih. gov) is a popular chemical information
resource that serves a wide range of use cases. In the past two years, a number of changes …
resource that serves a wide range of use cases. In the past two years, a number of changes …
Per-and polyfluoroalkyl substances (PFAS) in PubChem: 7 million and growing
EL Schymanski, J Zhang, PA Thiessen… - Environmental …, 2023 - ACS Publications
Per-and polyfluoroalkyl substances (PFAS) are of high concern, with calls to regulate them
as a class. In 2021, the Organisation for Economic Co-operation and Development (OECD) …
as a class. In 2021, the Organisation for Economic Co-operation and Development (OECD) …
[HTML][HTML] Database resources of the National Center for Biotechnology Information in 2023
Abstract The National Center for Biotechnology Information (NCBI) provides online
information resources for biology, including the GenBank® nucleic acid sequence database …
information resources for biology, including the GenBank® nucleic acid sequence database …
Exploring chemical information in PubChem
S Kim - Current protocols, 2021 - Wiley Online Library
Abstract PubChem (https://pubchem. ncbi. nlm. nih. gov) is a public chemical database that
serves scientific communities as well as the general public. This database collects chemical …
serves scientific communities as well as the general public. This database collects chemical …
A curated diverse molecular database of blood-brain barrier permeability with chemical descriptors
The highly-selective blood-brain barrier (BBB) prevents neurotoxic substances in blood from
crossing into the extracellular fluid of the central nervous system (CNS). As such, the BBB …
crossing into the extracellular fluid of the central nervous system (CNS). As such, the BBB …
[HTML][HTML] PubChem protein, gene, pathway, and taxonomy data collections: bridging biology and chemistry through target-centric views of PubChem data
Abstract PubChem (https://pubchem. ncbi. nlm. nih. gov) is a public chemical database at the
US National Institutes of Health. Visited by millions of users every month, it plays a role as a …
US National Institutes of Health. Visited by millions of users every month, it plays a role as a …