A Tribute to Gregory A. Voth

被引:0
|
作者
Jin, Jaehyeok [1 ]
Noid, William G. [2 ]
Li, Jianing [3 ]
Kumar, Revati [4 ]
Cao, Jianshu [5 ]
Jang, Seogjoo [6 ,7 ]
Paesani, Francesco [8 ]
Reichman, David [1 ]
机构
[1] Columbia Univ, Dept Chem, New York, NY 10027 USA
[2] Penn State Univ, Dept Chem, University Pk, PA 16802 USA
[3] Purdue Univ, Borch Dept Med Chem & Mol Pharmacol, W Lafayette, IN 47907 USA
[4] Louisiana State Univ, Dept Chem, Baton Rouge, LA 70803 USA
[5] MIT, Dept Chem, Cambridge, MA 02139 USA
[6] CUNY, Queens Coll, Dept Chem & Biochem, Queens, NY 11367 USA
[7] CUNY, PhD Programs Chem & Phys, Grad Ctr, New York, NY 10016 USA
[8] Univ Calif La Jolla, Halicioglu Data Sci Inst, San Diego Supercomp Ctr, Dept Chem & Biochem Mat Sci & Engn, La Jolla, CA 92093 USA
来源
JOURNAL OF PHYSICAL CHEMISTRY B | 2024年 / 128卷 / 32期
关键词
PATH CENTROID DENSITY; MOLECULAR-DYNAMICS SIMULATION; VALENCE-BOND MODEL; PROTON TRANSPORT; HYDRATED PROTON; COMPUTER-SIMULATION; FORMULATION; SOLVATION; HYDROLYSIS; MECHANISM;
D O I
10.1021/acs.jpcb.4c04455
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:7703 / 7706
页数:4
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