Ab initio calculation of real solids via neural network ansatz
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Toward Structural Dynamics: Protein Motions Viewed by Chemical Shift Modulations and Direct Detection of C′N Multiple-Quantum Relaxation,Journal of the American Chemical Society - X-MOL
Deep neural electronic wave functions - ECHEMI
Autoregressive neural-network wavefunctions for ab initio quantum
Autoregressive neural-network wavefunctions for ab initio quantum chemistry
Electron density of H10 chains The horizontal axis is scaled by the
Ab initio quantum chemistry with neural-network wavefunctions
Frontiers Machine learning meets quantum mechanics in catalysis
Autoregressive neural-network wavefunctions for ab initio quantum
PDF] Supplementing Recurrent Neural Network Wave Functions with
AI in computational chemistry through the lens of a decade-long journey - Chemical Communications (RSC Publishing) DOI:10.1039/D4CC00010B
Impact of conditional modelling for a universal autoregressive
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