About: Controlling structure and function of biomolecules at the molecular scale: theory meets experiment

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An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Projekt, within Data Space : linked.opendata.cz associated with source document(s)

Attributes	Values
rdf:type	http://linked.opendata.cz/ontology/domain/vavai/Projekt
rdfs:seeAlso	http://www.isvav.cz/projectDetail.do?rowId=GBP208/12/G016
Description	In this project a novel strategy for controlling the structure and function of biological systems at the molecular level is designed. This approach will be based on the development of experimental and computational methods for the quantitative description of noncovalent interactions in extended systems. The methodology will be applied to systems in which the noncovalent interactions play a crucial role in controlling (quasi)reversible processes for following mutually interconnected problems: i) protein-ligand interactions and in silico design of new ligands that exhibit novel properties, ii)interactions involving proteins and phospholipid membranes in aqueous solutions important for enzymatic activity and membrane permeability, and iii) interactions between protein, peptides and smaller pharmaceutically relevant molecules and carbon-based nanostructures as potential drug carriers.This interdisciplinary approach requires an interplay between computational chemistry, medicinal chemistry, biochemistry, organic chemistry and structural biology. (en) V předkládaném projektu je navržena nová metodologie řízení struktury a funkce biologických systémů na molekulové úrovni. Metodologie je založena na vývoji experimentálních a výpočetních metod pro kvantitativní popis nekovalentních interakcí ve velkých molekulových systémech. Uvedený přístup bude aplikován na systémy, ve kterých nekovalentní interakce hrají klíčovou roli při kontrole (kvazi)reverzibilních procesů pro následující vzájemně propojené systémy: i) interakce mezi proteiny a ligandy a in silico modelování ligandů s novými vlastnostmi, ii) interakce mezi proteiny a fosfo-lipidovými membránami ve vodných roztocích, které jsou důležité pro enzymatickou aktivitu a prostupnost membrán, iii) interakce proteinů, peptidů a malých farmaceuticky relevantních molekul s nanostrukturami uhlíku, které jsou potenciálními transportery léčiv. Tento mezioborový přístup vyžaduje propojení mezi výpočetní chemií, medicinální chemií, biochemií, organickou chemií a strukturální biologií.
Title	Controlling structure and function of biomolecules at the molecular scale: theory meets experiment (en) Řízení struktury a funkce biomolekul na molekulové úrovni: souhra teorie a experimentu
skos:notation	GBP208/12/G016
http://linked.open...avai/cep/aktivita	Projects for promotion of excellence in basic research
http://linked.open...kovaStatniPodpora	http://linked.opendata.cz/resource/domain/vavai/projekt/GBP208%2F12%2FG016/celkovaStatniPodpora
http://linked.open...ep/celkoveNaklady	http://linked.opendata.cz/resource/domain/vavai/projekt/GBP208%2F12%2FG016/celkoveNaklady
http://linked.open...datumDodatniDoRIV	2015-02-09 (xsd:date)
http://linked.open...i/cep/druhSouteze	VS - Veřejná soutěž ve výzkumu a vývoji
http://linked.open...ep/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open.../cep/fazeProjektu	101114182
http://linked.open...ai/cep/hlavniObor	CF - Fyzikální chemie a teoretická chemie
http://linked.open...vai/cep/kategorie	ZV - Základní výzkum
http://linked.open.../cep/klicovaSlova	non-covalent interactions structure and function of biomolecules theory and experiment (en)
http://linked.open...ep/partnetrHlavni	Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...inujicichPrijemcu	0 (xsd:int)
http://linked.open...cep/pocetPrijemcu	1 (xsd:int)
http://linked.open...ocetSpoluPrijemcu	3 (xsd:int)
http://linked.open.../pocetVysledkuRIV	149 (xsd:int)
http://linked.open...enychVysledkuVRIV	149 (xsd:int)
http://linked.open...lneniVMinulemRoce	2014-04-07 (xsd:date)
http://linked.open.../prideleniPodpory	http://linked.opendata.cz/resource/domain/vavai/cep/prideleniPodpory/P208-12-G016
http://linked.open...iciPoslednihoRoku	2015
http://linked.open...atUdajeProjZameru	2015
http://linked.open.../vavai/cep/soutez	SGA02012GA-GB
http://linked.open...usZobrazovaneFaze	DRRVB
http://linked.open...ai/cep/typPojektu	P - Projekt výzkumu a vývoje financovaný ze státního rozpočtu
http://linked.open...ep/ukonceniReseni	2018-12-31 (xsd:date)
http://linked.open.../cep/vedlejsiObor	CE - Biochemie
http://linked.open...ep/zahajeniReseni	2012-01-01 (xsd:date)
http://linked.open...tniCyklusProjektu	ZBBB
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