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Selecting users for participation in IT projects: Trading a representative sample for advocates and champions?, , , и . Interact. Comput., 23 (2): 176-187 (2011)PHAISTOS: A framework for Markov chain Monte Carlo simulation and inference of protein structure., , , , , , , , , и 7 other автор(ы). J. Comput. Chem., 34 (19): 1697-1705 (2013)#COVIDisAirborne: AI-enabled multiscale computational microscopy of delta SARS-CoV-2 in a respiratory aerosol., , , , , , , , , и 42 other автор(ы). Int. J. High Perform. Comput. Appl., 37 (1): 28-44 (2023)UNiTE: Unitary N-body Tensor Equivariant Network with Applications to Quantum Chemistry., , , , , и . CoRR, (2021)On the role of gradients for machine learning of molecular energies and forces., и . Mach. Learn. Sci. Technol., 1 (4): 45018 (2020)An assessment of the structural resolution of various fingerprints commonly used in machine learning., , , , , , , , и . Mach. Learn. Sci. Technol., 2 (1): 15018 (2021)Neural networks and kernel ridge regression for excited states dynamics of CH2NH$_2^+$: From single-state to multi-state representations and multi-property machine learning models., , , , и . Mach. Learn. Sci. Technol., 1 (2): 25009 (2020)