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Journal of Chemical Theory and Computation|April 6, 2016
Implementation of Analytical Energy Gradient of Spin-Dependent General Hartree-Fock Method Based on the Infinite-Order Douglas-Kroll-Hess Relativistic Hamiltonian with Local Unitary TransformationYuya Nakajima, Junji Seino, Hiromi Nakai
Journal of Computational Chemistry|April 30, 2024
Using atomic clustering based on structural and electronic descriptors that consider surrounding environment to evaluate local properties of DFT functionalsYuya Nakajima, Takuto Ohmura, Junji Seino
The Journal of Chemical Physics|January 7, 2014
Analytical energy gradient based on spin-free infinite-order Douglas-Kroll-Hess method with local unitary transformationYuya Nakajima, Junji Seino, Hiromi Nakai
ACS Medicinal Chemistry Letters|April 16, 2021
A Set of Highly Sensitive Sirtuin Fluorescence Probes for Screening Small-Molecular Sirtuin Defatty-Acylase InhibitorsYuya Nakajima, Mitsuyasu Kawaguchi, Naoya Ieda, et al.
Diabetology International|October 29, 2024
Effects of weight loss from oral semaglutide administration on cardiometabolic risk factors in Japanese patients with type 2 diabetes: a retrospective analysis using propensity score matchingKazuki Aoyama, Yuya Nakajima, Shu Meguro, et al.
Journal of Computational Chemistry|July 24, 2025
Large-Scale Calculations by Integrating the Fragmentation Approach With Neural Network PotentialsRei Oshima, Mikito Fujinami, Yuya Nakajima, et al.
Work (Reading, Mass.)|May 17, 2024
Cognitive and self-regulation skills for employment among people with brain injury: A comparison of employed and non-employed people using mixed analysisTomoko Miyahara, Yuya Nakajima, Atsuo Naya, et al.
Geriatrics (Basel, Switzerland)|October 25, 2024
Pilot Study on Gaze Characteristics of Older Drivers While Watching Driving MoviesKaori Kawabata, Yuya Nakajima, Kazuki Fujita, et al.
Molecules (Basel, Switzerland)|May 13, 2023
Thiocholine-Mediated One-Pot Peptide Ligation and DesulfurizationSae Suzuki, Yuya Nakajima, Naoki Kamo, et al.
Progress in Rehabilitation Medicine|July 31, 2024
Characteristics of Visual Cognition in Patients with Anoxic Encephalopathy: An Eye-tracking StudyYuya Nakajima, Nobuhiro Takahashi, Kaori Kawabata, et al.
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