New QM/MM Implementation of the MOPAC2012 in the GROMACS. - Arthur O. Zalevsky; Roman V. Reshetnikov; Andrey V. Golovin (RuSCDays, 2018)

New Binding Mode of SLURP Protein to a7 Nicotinic Acetylcholine Receptor Revealed by Computer Simulations. - Igor D. Diankin; Denis S. Kudryavtsev; Arthur O. Zalevsky; Victor I. Tsetlin; Andrey V. Golovin (Supercomput. Front. Innov., 2018)

RCSB Protein Data Bank (RCSB.org): delivery of experimentally-determined PDB structures alongside one million computed structure models of proteins from artificial intelligence/machine learning. - Stephen K. Burley; Charmi Bhikadiya; Chunxiao Bi; Sebastian Bittrich; Henry Chao; Li Chen 022; Paul A. Craig; Gregg V. Crichlow; Kenneth Dalenberg; Jose M. Duarte; Shuchismita Dutta; Maryam Fayazi; et al. (Nucleic Acids Res., 2023)