Laixue Pang

Publication Activity (10 Years)

Years Active: 2020-2021
Publications (10 Years): 4

Top Topics

Protein Folding

Molecular Dynamics

Top Venues

Comput. Biol. Medicine

J. Chem. Inf. Model.

J. Comput. Aided Mol. Des.

Publications

Jianzhong Chen, Lifei Wang, Wei Wang, Haibo Sun, Laixue Pang, Huayin Bao
Conformational transformation of switch domains in GDP/K-Ras induced by G13 mutants: An investigation through Gaussian accelerated molecular dynamics simulations and principal component analysis. Comput. Biol. Medicine 135 (2021)
Jianzhong Chen, Wei Wang, Haibo Sun, Laixue Pang, Huayin Bao
Binding mechanism of inhibitors to p38α MAP kinase deciphered by using multiple replica Gaussian accelerated molecular dynamics and calculations of binding free energies. Comput. Biol. Medicine 134 (2021)
Jianzhong Chen, Shaolong Zhang, Wei Wang, Laixue Pang, Qinggang Zhang, Xinguo Liu
Mutation-Induced Impacts on the Switch Transformations of the GDP- and GTP-Bound K-Ras: Insights from Multiple Replica Gaussian Accelerated Molecular Dynamics and Free Energy Analysis. J. Chem. Inf. Model. 61 (4) (2021)
Jianzhong Chen, Wei Wang, Haibo Sun, Laixue Pang, Baohua Yin
Mutation-mediated influences on binding of anaplastic lymphoma kinase to crizotinib decoded by multiple replica Gaussian accelerated molecular dynamics. J. Comput. Aided Mol. Des. 34 (12) (2020)