Results 1 to 10 of about 6,618,082 (389)
Augmenting large language models with chemistry tools [PDF]
Nat. Mac. Intell., 2023 Large language models (LLMs) have shown strong performance in tasks across domains but struggle with chemistry-related problems. These models also lack access to external knowledge sources, limiting their usefulness in scientific applications.
Andrés M Bran +5 more
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Acknowledgment to Reviewers of Chemistry in 2020
Chemistry, 2021 Peer review is the driving force of journal development, and reviewers are gatekeepers who ensure that Chemistry maintains its standards for the high quality of its published papers [...]
Chemistry Editorial Office
doaj +1 more source
The ORCA quantum chemistry program package.
Journal of Chemical Physics, 2020 In this contribution to the special software-centered issue, the ORCA program package is described. We start with a short historical perspective of how the project began and go on to discuss its current feature set.
F. Neese +3 more
semanticscholar +1 more source
Scientific Reports, 2017 To be effective as a drug, a potent molecule must reach its target in the body in sufficient concentration, and stay there in a bioactive form long enough for the expected biologic events to occur.
Antoine Daina, O. Michielin, V. Zoete
semanticscholar +1 more source
Engineering Chemistry, 2019 The use of ionic liquids (ILs) as organocatalysts is reviewed for transesterification reactions, specifically for the conversion of nontoxic compounds such as dialkyl carbonates to both linear mono-transesterification products or alkylene carbonates.
D. Ryabukhin +8 more
semanticscholar +1 more source
In situ click chemistry generation of cyclooxygenase-2 inhibitors
Nature Communications, 2017 Cyclooxygenase-2 isozyme is a promising anti-inflammatory drug target, and overexpression of this enzyme is also associated with several cancers and neurodegenerative diseases.
A. Bhardwaj, J. Kaur, M. Wuest, F. Wuest
semanticscholar +1 more source
Journal of chemistry, 2019 Heavy metals are well-known environmental pollutants due to their toxicity, persistence in the environment, and bioaccumulative nature. Their natural sources include weathering of metal-bearing rocks and volcanic eruptions, while anthropogenic sources ...
H. Ali, Ezzat Khan, I. Ilahi
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Atmospheric Chemistry and Physics: From Air Pollution to Climate Change
, 1998 Expanded and updated with new findings and new features • New chapter on Global Climate providing a self-contained treatment of climate forcing, feedbacks, and climate sensitivity • New chapter on Atmospheric Organic Aerosols and new treatment of the ...
J. Seinfeld, S. Pandis, K. Noone
semanticscholar +1 more source
Aquatic Chemistry: Chemical Equilibria and Rates in Natural Waters
, 1970 Chemical Thermodynamics and Kinetics Acid-Base Dissolved Carbon Dioxide Atmosphere-Water Interactions Metal Ions in Aqueous Solution Aspects of Coordination Chemistry Precipitation and Dissolution Oxidation and Reduction Equilibria the Solid-Solution ...
W. Stumm, J. J. Morgan
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, 1978 Lange's Handbook has served as a leading source of reliable chemical information and data for chemists, engineers, and other technical specialists since l934.
J. Dean
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