Kuzma Khrabrov Anton Ber Artem Tsypin Konstantin Ushenin Egor Rumiantsev Alexander Telepov Dmitry Protasov Ilya Shenbin Anton M. Alekseev Mikhail Shirokikh Sergey Nikolenko Elena Tutubalina Artur Kadurin
∇^2DFT: A Universal Quantum Chemistry Dataset of Drug-Like Molecules and a Benchmark for Neural Network Potentials