| Year |
Citation |
Score |
| 2019 |
Hwang H, Hazel A, Lian P, Smith JC, Gumbart JC, Parks JM. A Minimal Membrane Metal Transport System: Dynamics and Energetics of mer Proteins. Journal of Computational Chemistry. PMID 31721253 DOI: 10.1002/Jcc.26098 |
0.469 |
|
| 2019 |
Lian P, Guo L, Devarajan D, Parks JM, Painter SL, Brooks SC, Smith JC. The AQUA-MER databases and aqueous speciation server: A web resource for multiscale modeling of mercury speciation. Journal of Computational Chemistry. PMID 31603259 DOI: 10.1002/Jcc.26081 |
0.437 |
|
| 2018 |
Lian P, Johnston RC, Parks JM, Smith JC. Quantum Chemical Calculation of p Ks of Environmentally Relevant Functional Groups: Carboxylic Acids, Amines and Thiols in Aqueous Solution. The Journal of Physical Chemistry. A. PMID 29633840 DOI: 10.1021/Acs.Jpca.8B01751 |
0.449 |
|
| 2018 |
Kanzler CR, Lian P, Trainer EL, Yang X, Govind N, Parks JM, Graham AM. Emerging investigator series: methylmercury speciation and dimethylmercury production in sulfidic solutions. Environmental Science. Processes & Impacts. PMID 29388993 DOI: 10.1039/C7Em00533D |
0.316 |
|
| 2018 |
Devarajan D, Lian P, Brooks SC, Parks JM, Smith JC. Quantum Chemical Approach for Calculating Stability Constants of Mercury Complexes Acs Earth and Space Chemistry. 2: 1168-1178. DOI: 10.1021/Acsearthspacechem.8B00102 |
0.473 |
|
| 2016 |
Lian P, Yuan C, Xu Q, Fu W. Thermostability Mechanism for the Hyperthermophilicity of Extremophile Cellulase TmCel12A: Implied from Molecular Dynamics Simulation. The Journal of Physical Chemistry. B. PMID 27384708 DOI: 10.1021/Acs.Jpcb.6B03782 |
0.375 |
|
| 2015 |
Lian P, Wei D. An application of QM/MM simulation: the second protonation of cytochrome P450. Advances in Experimental Medicine and Biology. 827: 311-24. PMID 25387972 DOI: 10.1007/978-94-017-9245-5_18 |
0.532 |
|
| 2014 |
Lian P, Guo HB, Riccardi D, Dong A, Parks JM, Xu Q, Pai EF, Miller SM, Wei DQ, Smith JC, Guo H. X-ray structure of a Hg2+ complex of mercuric reductase (MerA) and quantum mechanical/molecular mechanical study of Hg2+ transfer between the C-terminal and buried catalytic site cysteine pairs. Biochemistry. 53: 7211-22. PMID 25343681 DOI: 10.1021/Bi500608U |
0.549 |
|
| 2014 |
Ma LN, Du ZZ, Lian P, Wei DQ. A theoretical study on the mechanism of a superficial mutation inhibiting the enzymatic activity of CYP1A2. Interdisciplinary Sciences, Computational Life Sciences. 6: 25-31. PMID 24464701 DOI: 10.1007/S12539-014-0184-2 |
0.467 |
|
| 2014 |
Lian P, Guo HB, Smith JC, Wei DQ, Guo H. Catalytic mechanism and origin of high activity of cellulase TmCel12A at high temperature: A quantum mechanical/molecular mechanical study Cellulose. 21: 937-949. DOI: 10.1007/S10570-013-0011-7 |
0.573 |
|
| 2013 |
Lian P, Li J, Wang DQ, Wei DQ. Car-Parrinello molecular dynamics/molecular mechanics (CPMD/MM) simulation study of coupling and uncoupling mechanisms of Cytochrome P450cam. The Journal of Physical Chemistry. B. 117: 7849-56. PMID 23742631 DOI: 10.1021/Jp312107R |
0.535 |
|
| 2011 |
Lian P, Wei DQ, Wang JF, Chou KC. An allosteric mechanism inferred from molecular dynamics simulations on phospholamban pentamer in lipid membranes. Plos One. 6: e18587. PMID 21525996 DOI: 10.1371/Journal.Pone.0018587 |
0.489 |
|
| 2010 |
Chang J, Lian P, Wei DQ, Chen XR, Zhang QM, Gong ZZ. Thermal decomposition of the solid phase of nitromethane: ab initio molecular dynamics simulations. Physical Review Letters. 105: 188302. PMID 21231142 DOI: 10.1103/Physrevlett.105.188302 |
0.516 |
|
| 2010 |
Lian P, Liu LA, Shi Y, Bu Y, Wei D. Tethered-hopping model for protein-DNA binding and unbinding based on Sox2-Oct1-Hoxb1 ternary complex simulations. Biophysical Journal. 98: 1285-93. PMID 20371328 DOI: 10.1016/J.Bpj.2009.12.4274 |
0.472 |
|
| 2010 |
Chang J, Lian P, Wei D, Chen X, Zhang Q, Gong Z. Publisher's Note: Thermal Decomposition of the Solid Phase of Nitromethane: Ab Initio Molecular Dynamics Simulations [Phys. Rev. Lett. 105, 188302 (2010)] Physical Review Letters. 105: 229902. DOI: 10.1103/Physrevlett.105.229902 |
0.486 |
|
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