Publications by authors named "Toma Miyagishi"
Article Synopsis
- * The research utilizes the fragment molecular orbital (FMO) method on a dataset comprising over 5,000 protein structures from the SCOP2 database, resulting in more than 200 million inter-fragment interaction energies.
- * Multiple basis sets were applied to improve accuracy in energy calculations, and the total dataset size is approximately 6.7 GB, which can aid in functional analyses and machine learning applications related to protein properties.
