ArticleJournal of chemical theory and computation2025
DESC: An Automated Strategy to Efficiently Account for Dynamic Environment Effects in Solution.
Article in Journal of chemical theory and computation, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.
What it found
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The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
The trial behind it
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Authors and funding
3 authors.
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Abstract
The properties and dynamic behavior of molecules in liquid solutions depend critically on the solvent and other species, or cosolutes, including electrolytes (if present), especially when molecular association or pairing occurs. In Quantum Mechanical (QM) calculations, the electronic structure of molecules in liquid solution is typically obtained with implicit solvent models (ISMs). However, ISMs cannot differentiate between, for example, cation types (e.g., Cs
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Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.