[HTML][HTML] Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - Elsevier
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

[HTML][HTML] Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - ncbi.nlm.nih.gov
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - tohoku.elsevierpure.com
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase.

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - europepmc.org
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - pubmed.ncbi.nlm.nih.gov
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - da.lib.kobe-u.ac.jp
Yinglei Sheng a, Hirofumi Watanabe b,⁎, Keiya Maruyama a, Chiduru Watanabe c, Yoshio
Okiyama c, d, Teruki Honma c, Kaori Fukuzawa e, Shigenori Tanaka a,⁎ a Graduate School …

[HTML][HTML] Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - csbj.org
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, K Maruyama, C Watanabe… - Computational and …, 2018 - cir.nii.ac.jp
抄録 We describe several procedures for the preprocessing of fragment molecular orbital
(FMO) calculations on p38 mitogen-activated protein (MAP) kinase and discuss the …

Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase.

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - europepmc.org
We describe several procedures for the preprocessing of fragment molecular orbital (FMO)
calculations on p38 mitogen-activated protein (MAP) kinase and discuss the influence of the …

[引用][C] Towards good correlation between fragment molecular orbital interaction energies and experimental IC50 for ligand binding: A case study of p38 MAP kinase

Y Sheng, H Watanabe, K Maruyama… - Computational and …, 2018 - cir.nii.ac.jp
Towards good correlation between fragment molecular orbital interaction energies and
experimental IC50 for ligand binding: A case study of p38 MAP kinase | CiNii Research CiNii …