383 citations · 768 across the 9 of their papers we have counts for
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cond-mat.stat-mech2023★ 5 cited
On data and dimension in chemistry -- irreversibility, concealment and emergent conservation laws
Alex Blokhuis, Martijn van Kuppeveld, Daan van de Weem +1
Chemical systems are interpreted through the species they contain and the reactions they may undergo, i.e., their chemical reaction network (CRN). In spite of their central importa…
physics.chem-ph2023★ 25 cited
Recent advances in the Self-Referencing Embedding Strings (SELFIES) library
Alston Lo, Robert Pollice, AkshatKumar Nigam +3
String-based molecular representations play a crucial role in cheminformatics applications, and with the growing success of deep learning in chemistry, have been readily adopted in…