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COSMIC: Molecular Conformation Space Modeling in Internal Coordinates with an Adversarial Framework.
Maksim Kuznetsov
Fedor Ryabov
Roman Schutski
Rim Shayakhmetov
Yen-Chu Lin
Alex Aliper
Daniil Polykovskiy
Published in:
J. Chem. Inf. Model. (2024)
Keyphrases
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conceptual framework
modeling framework
genetic algorithm
cartesian coordinates
knowledge base
case study
multi agent
main contribution
theoretical framework
data sets
three dimensional
fine grained
internal and external