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Akio Kitao

5PUBLICATIONS

7CO-AUTHORS

Chemical thermodynamics and energeticsStatistical mechanics in chemistryBiomolecular modelling and designComputational chemistry

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Publications (5)

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|Nov 10, 2020

Erratum: "Edge expansion parallel cascade selection molecular dynamics simulation for investigating large-amplitude collective motions of proteins" [J. Chem. Phys. 152, 225101 (2020)].

Kenichiro Takaba, Duy Phuoc Tran, Akio Kitao

|Jun 15, 2020

Edge expansion parallel cascade selection molecular dynamics simulation for investigating large-amplitude collective motions of proteins.

Kenichiro Takaba, Duy Phuoc Tran, Akio Kitao

|Dec 12, 2019

evERdock BAI: Machine-learning-guided selection of protein-protein complex structure.

Kei Terayama, Ai Shinobu, Koji Tsuda

|Nov 24, 2018

Refining evERdock: Improved selection of good protein-protein complex models achieved by MD optimization and use of multiple conformations.

Ai Shinobu, Kazuhiro Takemura, Nobuyuki Matubayasi

|Mar 17, 2018

Binding free energy analysis of protein-protein docking model structures by evERdock.

Kazuhiro Takemura, Nobuyuki Matubayasi, Akio Kitao

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Frequent Collaborators

2 joint publications

Nobuyuki Matubayasi

2 joint publications

Kenichiro Takaba

2 joint publications

Duy Phuoc Tran

1 joint publications

Kei Terayama

1 joint publications

Ai Shinobu

1 joint publications

Koji Tsuda

1 joint publications

Kazuhiro Takemura

Frequent Collaborators

2 joint publications

Nobuyuki Matubayasi

2 joint publications

Kenichiro Takaba

2 joint publications

Duy Phuoc Tran

1 joint publications

Kei Terayama

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