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Solution scattering approaches to dynamical ordering in biomolecular systems
Bernadó, Pau, Shimizu, Nobutaka, Zaccai, Giuseppe, Kamikubo, Hironari, Sugiyama, Masaaki
Published in Biochimica et biophysica acta (01.02.2018)
Published in Biochimica et biophysica acta (01.02.2018)
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Theoretical approaches for dynamical ordering of biomolecular systems
Okumura, Hisashi, Higashi, Masahiro, Yoshida, Yuichiro, Sato, Hirofumi, Akiyama, Ryo
Published in Biochimica et biophysica acta (01.02.2018)
Published in Biochimica et biophysica acta (01.02.2018)
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Systematic QM Region Construction in QM/MM Calculations Based on Uncertainty Quantification
Brandt, Felix, Jacob, Christoph R
Published in Journal of chemical theory and computation (12.04.2022)
Published in Journal of chemical theory and computation (12.04.2022)
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Accurate Computation of Thermodynamic Activation Parameters in the Chorismate Mutase Reaction from Empirical Valence Bond Simulations
Wilkins, Ryan Scott, Lund, Bjarte Aarmo, Isaksen, Geir Villy, Åqvist, Johan, Brandsdal, Bjørn Olav
Published in Journal of chemical theory and computation (09.01.2024)
Published in Journal of chemical theory and computation (09.01.2024)
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Long Time Scale Ensemble Methods in Molecular Dynamics: Ligand–Protein Interactions and Allostery in SARS-CoV‑2 Targets
Bhati, Agastya P., Hoti, Art, Potterton, Andrew, Bieniek, Mateusz K., Coveney, Peter V.
Published in Journal of chemical theory and computation (13.06.2023)
Published in Journal of chemical theory and computation (13.06.2023)
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Single-molecule imaging and manipulation of biomolecular machines and systems
Iino, Ryota, Iida, Tatsuya, Nakamura, Akihiko, Saita, Ei-ichiro, You, Huijuan, Sako, Yasushi
Published in Biochimica et biophysica acta (01.02.2018)
Published in Biochimica et biophysica acta (01.02.2018)
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Solution NMR views of dynamical ordering of biomacromolecules
Ikeya, Teppei, Ban, David, Lee, Donghan, Ito, Yutaka, Kato, Koichi, Griesinger, Christian
Published in Biochimica et biophysica acta (01.02.2018)
Published in Biochimica et biophysica acta (01.02.2018)
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Recent advances in QM/MM free energy calculations using reference potentials
Duarte, Fernanda, Amrein, Beat A., Blaha-Nelson, David, Kamerlin, Shina C.L.
Published in Biochimica et biophysica acta (01.05.2015)
Published in Biochimica et biophysica acta (01.05.2015)
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Dynamic membrane interactions of antibacterial and antifungal biomolecules, and amyloid peptides, revealed by solid-state NMR spectroscopy
Naito, Akira, Matsumori, Nobuaki, Ramamoorthy, Ayyalusamy
Published in Biochimica et biophysica acta. General subjects (01.02.2018)
Published in Biochimica et biophysica acta. General subjects (01.02.2018)
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