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期刊名称：JOURNAL OF CHEMICAL THEORY AND COMPUTATION ISSN： 1549-9618 出版频率： Monthly 出版社： AMER CHEMICAL SOC, 1155 16TH ST, NW, WASHINGTON, USA, DC, 20036   出版社网址： http://pubs.acs.org/ 期刊网址： http://pubs.acs.org/journal/jctcce 影响因子： 6.006 主题范畴： CHEMISTRY, PHYSICAL;    PHYSICS, ATOMIC, MOLECULAR & CHEMICAL 期刊简介(About the journal)    投稿须知(Instructions to Authors)    编辑部信息(Editorial Board)    About the journal The Journal of Chemical Theory and Computation publishes papers reporting new theories, methodology, and/or important applications in quantum electronic structure, molecular dynamics, and statistical mechanics. Specific topics include advances in or applications of ab initio quantum mechanics, density functional theory, design and properties of new materials, surface science, Monte Carlo simulations, solvation models, QM/MM calculations, biomolecular structure prediction, and molecular dynamics in the broadest sense including gas phase dynamics, ab initio dynamics, biomolecular dynamics, and protein folding. JCTC ranks in the top 20 in Multidisciplinary Chemistry with an ISI Impact Factor of 4.274. Abstracted/Indexed in: CAS, SCOPUS, British Library, and Web of Science. Instructions to Authors Authors are encouraged to use the Journal of Chemical Theory and Computation Document Templates below for preparing manuscripts for submission as well as for preparing final, accepted manuscripts. See also Manuscript Preparation and Submission for complete information on acceptable software, preparing and submitting manuscripts using TeX/LaTeX, correct preparation of graphics, etc. NOTE: Authors may now choose to submit their own Manuscript PDF File for use during the peer review process, or allow the system to generate a PDF automatically. Note that there are also special instructions for Preparing and Submitting Manuscripts Using TeX/LaTeX. Document Templates The templates are available below. Use of a template is encouraged but not mandatory. All accepted manuscripts are typeset from electronic files. The template facilitates the peer review process by allowing authors to place artwork and tables close to the point where they are discussed within the text. Please use U.S. Letter (8 1/2" by 11") paper size setting in the word processing program as the original document page size for preparation of all manuscripts. Do not use A4 or other size paper settings. Please read the appropriate README file before downloading the template. This file contains more detailed information on what to expect when you download and use a template. Click on a link below to download the appropriate template that corresponds to the version of the word processing software on your computer. Instructions to Authors jctcce_authguide.pdf Editorial Board William L. Jorgensen Department of Chemistry Yale University 225 Prospect Street P.O. Box 208107 New Haven, CT 06520-8107 E-mail: eic@jctc.acs.org Phone: (203) 432-4118 Fax: (202) 513-8629 Editorial Advisory Board [PDF]   Gustavo E. Scuseria Department of Chemistry, MS-60 Rice University 6100 Main Street, P.O. Box 1892 Houston, TX 77251-1892 E-mail: jctc@rice.edu Phone: (713) 348-5336 Fax: (713) 348-2727 Associate Editors Ursula Rothlisberger Ecole Polytechnique Federale Lausanne E-mail: epfl-office@jctc.acs.org