Yu Takano, Hiroko X Kondo, Haruki Nakamura. Quantitative evaluation of noncovalent interactions with negative fragmentation approach including basis set superposition error correction. Bulletin of the Chemical Society of Japan. 2024. 97. 9
Hiroko X Kondo, Yu Takano. Structure comparison of heme-binding sites in heme protein predicted by AlphaFold3 and AlphaFold2. Chemistry Letters. 2024. 53. 8
Hiroko X. KONDO, Yu TAKANO. Hydrogen Bond Energies in Helical Peptides Investigated by Negative Fragmentation Approach with Density Functional Theory. Seibutsu Butsuri. 2024. 64. 2. 89-93
Yusuke Kanematsu, Hiroko X. Kondo, Yu Takano. Computational Exploration of Minimum Energy Reaction Pathway of N2O Formation from Intermediate I of P450nor Using an Active Center Model. International Journal of Molecular Sciences. 2023. 24. 24. 17172-17172
Hinako Fujikawa, Hiroko X. Kondo, Yusuke Kanematsu, Yu Takano. Random Forest Classifier of Heme Proteins Using Porphyrin Distortions and Axial Ligands of Heme. Chemistry Letters. 2023. 52. 6. 503-507
Hiroko X. Kondo, Noriaki Okimoto, Makoto Taiji. Improvement of Sampling Efficiency through Combined use of Molecular Dynamics Simulations with Implicit and Explicit Solvent Models. BIOPHYSICAL JOURNAL. 2013. 104. 2. 170A-171A
Hiroko Kondo, Noriaki Okimoto, Gentaro Morimoto, Makoto Taiji. Exploration of Free-Energy Profiles With Conformational Changes of Proteins. BIOPHYSICAL JOURNAL. 2010. 98. 3. 26A-26A