"N\u00E1stroj pro v\u00FDpo\u010Det pod\u00EDlu molekul a molekul\u00E1rn\u00EDch fragment\u016F"@cs . . . "N\u00E1stroj pro v\u00FDpo\u010Det pod\u00EDlu molekul a molekul\u00E1rn\u00EDch fragment\u016F" . . "Tento skript pro prost\u0159ed\u00ED MATLAB (mol_frag.m) byl vytvo\u0159en jako pomocn\u00FD n\u00E1stroj pro p\u0159\u00EDpravu po\u010D\u00EDta\u010Dov\u00FDch molekul\u00E1rn\u00EDch model\u016F a interpretaci experiment\u00E1ln\u00EDch dat z prvkov\u00E9 anal\u00FDzy. Vstupn\u00EDmi daty jsou hmotnostn\u00ED procenta prvk\u016F obsa\u017Een\u00FDch ve vzorku re\u00E1ln\u00E9ho materi\u00E1lu a seznam mo\u017En\u00FDch chemick\u00FDch l\u00E1tek (molekul, molekul\u00E1rn\u00EDch fragment\u016F) potenci\u00E1ln\u011B ve vzorku p\u0159\u00EDtomn\u00FDch. Molekuly/molekul\u00E1rn\u00ED fragmenty jsou zad\u00E1v\u00E1ny jako matice, ve sloupc\u00EDch jsou hmotnost\u00ED v\u0161ech prvk\u016F p\u0159\u00EDtomn\u00FDch v molekule (uhl\u00EDk, dus\u00EDk, kysl\u00EDk, apod., pro ka\u017Ed\u00FD prvek jeden sloupec), po\u010Det \u0159\u00E1dk\u016F odpov\u00EDd\u00E1 po\u010Dtu potenci\u00E1ln\u00EDch molekul/molekul\u00E1rn\u00EDch fragment\u016F. V\u00FDstupem je nejpravd\u011Bpodobn\u011Bj\u0161\u00ED pom\u011Br jednotliv\u00FDch l\u00E1tek ze seznamu, hmotnostn\u00ED procenta prvk\u016F, vypo\u010D\u00EDtan\u00E1 podle tohoto nejpravd\u011Bpodobn\u011Bj\u0161\u00EDho pom\u011Bru, a porovn\u00E1n\u00ED t\u011Bchto vypo\u010D\u00EDtan\u00FDch hmotnostn\u00EDch procent se zadan\u00FDmi hmotnostn\u00EDmi procenty." . "27640" . "1"^^ . "weight percent; elemental analysis; abundances of element"@en . . . "1"^^ . "N\u00E1stroj pro v\u00FDpo\u010Det pod\u00EDlu molekul a molekul\u00E1rn\u00EDch fragment\u016F"@cs . "RIV/61989100:27640/14:86087541!RIV15-MSM-27640___" . . . . "31668" . . "006/27-01-2014_SW" . "RIV/61989100:27640/14:86087541" . "http://www.it4i.cz/organizacni-struktura/vyzkumne-tymy/modelovani-pro-nanotechnologie/" . . . "Roz\u0161\u00ED\u0159en\u00ED mo\u017Enost\u00ED charakterizace materi\u00E1lu je v\u00FDhodn\u00E9 pro ka\u017Edou firmu \u010Di laborato\u0159 pracuj\u00EDc\u00ED v oblasti materi\u00E1lov\u00E9ho v\u00FDzkumu. Hlavn\u00ED benefit spo\u010D\u00EDv\u00E1 v p\u0159\u00EDm\u00E9 n\u00E1vaznosti na jednu z nejroz\u0161\u00ED\u0159en\u011Bj\u0161\u00EDch a v oblasti chemick\u00E9 anal\u00FDzy nej\u010Dast\u011Bji vyu\u017E\u00EDvan\u00FDch metod \u2013 prvkovou anal\u00FDzu." . "A tool for calculating the ratio of molecules and molecular fragments"@en . "Software slou\u017E\u00ED k interpretaci experiment\u00E1ln\u00EDch dat z prvkov\u00E9 anal\u00FDzy. Na z\u00E1klad\u011B zn\u00E1m\u00FDch hmotnostn\u00EDch procent prvk\u016F obsa\u017Een\u00FDch ve vzorku re\u00E1ln\u00E9ho materi\u00E1lu a seznamu mo\u017En\u00FDch chemick\u00FDch l\u00E1tek potenci\u00E1ln\u011B p\u0159\u00EDtomn\u00FDch ve vzorku dok\u00E1\u017Ee odhadnout nejpravd\u011Bpodobn\u011Bj\u0161\u00ED pom\u011Br l\u00E1tek, kter\u00E9 re\u00E1ln\u00FD vzorek obsahuje, a to v\u010Detn\u011B p\u0159\u00EDm\u011Bs\u00ED, kter\u00E9 jsou zastoupeny jen nepatrn\u00FDm mno\u017Estv\u00EDm. Toto je u\u017Eite\u010Dn\u00E9 jak v laboratorn\u00ED praxi, tak p\u0159i po\u010D\u00EDta\u010Dov\u00E9m molekul\u00E1rn\u00EDm modelov\u00E1n\u00ED, kde je d\u016Fle\u017Eit\u00E9 pracovat s modely co nejpodobn\u011Bj\u0161\u00EDmi re\u00E1ln\u00E9mu materi\u00E1lu." . "Tokarsk\u00FD, Jon\u00E1\u0161" . . . "N\u00E1stroj pro v\u00FDpo\u010Det pod\u00EDlu molekul a molekul\u00E1rn\u00EDch fragment\u016F" . . . "A tool for calculating the ratio of molecules and molecular fragments"@en . "Software slou\u017E\u00ED k interpretaci experiment\u00E1ln\u00EDch dat z prvkov\u00E9 anal\u00FDzy. Na z\u00E1klad\u011B zn\u00E1m\u00FDch hmotnostn\u00EDch procent prvk\u016F obsa\u017Een\u00FDch ve vzorku re\u00E1ln\u00E9ho materi\u00E1lu a seznamu mo\u017En\u00FDch chemick\u00FDch l\u00E1tek potenci\u00E1ln\u011B p\u0159\u00EDtomn\u00FDch ve vzorku dok\u00E1\u017Ee odhadnout nejpravd\u011Bpodobn\u011Bj\u0161\u00ED pom\u011Br l\u00E1tek, kter\u00E9 re\u00E1ln\u00FD vzorek obsahuje, a to v\u010Detn\u011B p\u0159\u00EDm\u011Bs\u00ED, kter\u00E9 jsou zastoupeny jen nepatrn\u00FDm mno\u017Estv\u00EDm. Toto je u\u017Eite\u010Dn\u00E9 jak v laboratorn\u00ED praxi, tak p\u0159i po\u010D\u00EDta\u010Dov\u00E9m molekul\u00E1rn\u00EDm modelov\u00E1n\u00ED, kde je d\u016Fle\u017Eit\u00E9 pracovat s modely co nejpodobn\u011Bj\u0161\u00EDmi re\u00E1ln\u00E9mu materi\u00E1lu."@cs . "[06167E075377]" . . "The software is designed for interpretation of the experimental data obtained from elemental analysis. According to known wt.% of elements in the sample and the list of chemical compound potentially present in the sample, the most probable ratio of molecules and molecular fragments can be estimated (including impurities represented by only a slight amount). This is useful not only in laboratory but also in computer molecular modeling studies because it is important to work with the models most similar to the real material."@en . . "P(ED1.1.00/02.0070)" .