Liu C - Search Results

1

An optimized charge penetration model for use with the AMOEBA force field.

Rackers JA, Wang Q, Liu C, Piquemal JP, Ren P, Ponder JW. Rackers JA, et al. Among authors: liu c. Phys Chem Chem Phys. 2016 Dec 21;19(1):276-291. doi: 10.1039/c6cp06017j. Phys Chem Chem Phys. 2016. PMID: 27901142 Free PMC article.

2

Capturing Many-Body Interactions with Classical Dipole Induction Models.

Liu C, Qi R, Wang Q, Piquemal JP, Ren P. Liu C, et al. J Chem Theory Comput. 2017 Jun 13;13(6):2751-2761. doi: 10.1021/acs.jctc.7b00225. Epub 2017 May 12. J Chem Theory Comput. 2017. PMID: 28482664 Free PMC article.

3

Study of interactions between metal ions and protein model compounds by energy decomposition analyses and the AMOEBA force field.

Jing Z, Qi R, Liu C, Ren P. Jing Z, et al. Among authors: liu c. J Chem Phys. 2017 Oct 28;147(16):161733. doi: 10.1063/1.4985921. J Chem Phys. 2017. PMID: 29096462 Free PMC article.

4

Elucidating the Phosphate Binding Mode of Phosphate-Binding Protein: The Critical Effect of Buffer Solution.

Qi R, Jing Z, Liu C, Piquemal JP, Dalby KN, Ren P. Qi R, et al. Among authors: liu c. J Phys Chem B. 2018 Jun 21;122(24):6371-6376. doi: 10.1021/acs.jpcb.8b03194. Epub 2018 Jun 11. J Phys Chem B. 2018. PMID: 29807433 Free PMC article.

5

Many-body effect determines the selectivity for Ca²⁺ and Mg²⁺ in proteins.

Jing Z, Liu C, Qi R, Ren P. Jing Z, et al. Among authors: liu c. Proc Natl Acad Sci U S A. 2018 Aug 7;115(32):E7495-E7501. doi: 10.1073/pnas.1805049115. Epub 2018 Jul 23. Proc Natl Acad Sci U S A. 2018. PMID: 30038003 Free PMC article.

6

A physically grounded damped dispersion model with particle mesh Ewald summation.

Rackers JA, Liu C, Ren P, Ponder JW. Rackers JA, et al. Among authors: liu c. J Chem Phys. 2018 Aug 28;149(8):084115. doi: 10.1063/1.5030434. J Chem Phys. 2018. PMID: 30193468 Free PMC article.

7

Polarizable Force Fields for Biomolecular Simulations: Recent Advances and Applications.

Jing Z, Liu C, Cheng SY, Qi R, Walker BD, Piquemal JP, Ren P. Jing Z, et al. Among authors: liu c. Annu Rev Biophys. 2019 May 6;48:371-394. doi: 10.1146/annurev-biophys-070317-033349. Epub 2019 Mar 27. Annu Rev Biophys. 2019. PMID: 30916997 Free PMC article. Review.

8

AMOEBA+ Classical Potential for Modeling Molecular Interactions.

Liu C, Piquemal JP, Ren P. Liu C, et al. J Chem Theory Comput. 2019 Jul 9;15(7):4122-4139. doi: 10.1021/acs.jctc.9b00261. Epub 2019 Jun 11. J Chem Theory Comput. 2019. PMID: 31136175 Free PMC article.

9

Implementation of Geometry-Dependent Charge Flux into the Polarizable AMOEBA+ Potential.

Liu C, Piquemal JP, Ren P. Liu C, et al. J Phys Chem Lett. 2020 Jan 16;11(2):419-426. doi: 10.1021/acs.jpclett.9b03489. Epub 2019 Dec 30. J Phys Chem Lett. 2020. PMID: 31865706 Free PMC article.

10

Three-site and five-site fixed-charge water models compatible with AMOEBA force field.

Pan C, Liu C, Peng J, Ren P, Huang X. Pan C, et al. Among authors: liu c. J Comput Chem. 2020 Apr 15;41(10):1034-1044. doi: 10.1002/jcc.26151. Epub 2020 Jan 24. J Comput Chem. 2020. PMID: 31976572

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