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10.1021/acs.chemrev.5b00644 http://scihub22266oqcxt.onion/10.1021/acs.chemrev.5b00644 C5450669!5450669!27186804     free     free     free Warning: file_get_contents(https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pubmed&id=27186804&cmd=llinks): Failed to open stream: HTTP request failed! HTTP/1.1 429 Too Many Requests in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 215 Deprecated: Implicit conversion from float 235.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 235.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 235.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 235.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 235.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 235.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534       Chem+Rev 2016 ; 116 (13): 7501-28 Nephropedia Template TP {{tp|p=27186804|t=2016. Modeling Molecular Interactions in Water: From Pairwise to Many-Body Potential Energy Functions |pdf=|usr=}}{{27186804}} gab.com Text Modeling Molecular Interactions in Water: From Pairwise to Many-Body Potential Energy Functions JO: Chem Rev http://www.kidney.de/pget.php?&tw=1&pmid=27186804 #FOAvip Almost 50 years have passed from the first computer simulations of water, and a large number of molecular models have been proposed since then to elucidate the unique behavior of water across different phases. In this article, we review the recent progress in the development of analytical potential energy functions that aim at correctly representing many-body effects. Starting from the many-body expansion of the interaction energy, specific focus is on different classes of potential energy functions built upon a hierarchy of approximations and on their ability to accurately reproduce reference data obtained from state-of-the-art electronic structure calculations and experimental measurements. We show that most recent potential energy functions, which include explicit short-range representations of two-body and three-body effects along with a physically correct description of many-body effects at all distances, predict the properties of water from the gas to the condensed phase with unprecedented accuracy, thus opening the door to the long-sought ?universal model? capable of describing the behavior of water under different conditions and in different environments. Twit Text FOAVip Modeling Molecular Interactions in Water: From Pairwise to Many-Body Potential Energy Functions ????Chem Rev http://www.kidney.de/pget.php?&tw=1&pmid=27186804 #FOAvip Twit Text # Free Paper on # # # # # LINK http://www.kidney.de/pget.php?&tw=1&pmid=27186804 #FOAvip English Wikipedia <ref>{{Cite pmid|27186804}}</ref> Modeling Molecular Interactions in Water: From Pairwise to Many-Body Potential Energy Functions #MMPMID27186804 Cisneros G; Wikfeldt KT; Ojamäe L; Lu J; Xu Y; Torabifard H; Bartók AP; Csányi G; Molinero V; Paesani F Chem Rev 2016[Jul]; 116 (13): 7501-28 PMID27186804show ga Almost 50 years have passed from the first computer simulations of water, and a large number of molecular models have been proposed since then to elucidate the unique behavior of water across different phases. In this article, we review the recent progress in the development of analytical potential energy functions that aim at correctly representing many-body effects. Starting from the many-body expansion of the interaction energy, specific focus is on different classes of potential energy functions built upon a hierarchy of approximations and on their ability to accurately reproduce reference data obtained from state-of-the-art electronic structure calculations and experimental measurements. We show that most recent potential energy functions, which include explicit short-range representations of two-body and three-body effects along with a physically correct description of many-body effects at all distances, predict the properties of water from the gas to the condensed phase with unprecedented accuracy, thus opening the door to the long-sought ?universal model? capable of describing the behavior of water under different conditions and in different environments. äModeling Molecular Interactions in Water: From Pairwise to Many-Body P(epmc).pdf DeepDyve Pubget Overpricing