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Publications by Pratim Kumar Chattaraj

Does Confinement Always Lead to Thermodynamically and/or Kinetically Favorable Reactions? A Case Study Using Diels-Alder Reactions Within ExBox+4 and CB[7]

Theoretical Chemistry

Molecular Physics,

English

NeVAE: A Deep Generative Model for Molecular Graphs

Proceedings of the AAAI Conference on Artificial Intelligence

English