| 000 | 01463 a2200373 4500 | ||
|---|---|---|---|
| 005 | 20250517061657.0 | ||
| 264 | 0 | _c20161007 | |
| 008 | 201610s 0 0 eng d | ||
| 022 | _a1873-4243 | ||
| 024 | 7 |
_a10.1016/j.jmgm.2015.10.001 _2doi |
|
| 040 |
_aNLM _beng _cNLM |
||
| 100 | 1 | _aMurce, Erika | |
| 245 | 0 | 0 |
_aStructure-based de novo design, molecular docking and molecular dynamics of primaquine analogues acting as quinone reductase II inhibitors. _h[electronic resource] |
| 260 |
_bJournal of molecular graphics & modelling _cNov 2015 |
||
| 300 |
_a235-244 p. _bdigital |
||
| 500 | _aPublication Type: Journal Article; Research Support, Non-U.S. Gov't | ||
| 650 | 0 | 4 | _aCatalytic Domain |
| 650 | 0 | 4 |
_aEnzyme Inhibitors _xchemistry |
| 650 | 0 | 4 | _aHumans |
| 650 | 0 | 4 | _aHydrogen Bonding |
| 650 | 0 | 4 | _aMolecular Docking Simulation |
| 650 | 0 | 4 | _aMolecular Dynamics Simulation |
| 650 | 0 | 4 |
_aPrimaquine _xanalogs & derivatives |
| 650 | 0 | 4 | _aProtein Binding |
| 650 | 0 | 4 | _aProtein Structure, Secondary |
| 650 | 0 | 4 |
_aQuinone Reductases _xantagonists & inhibitors |
| 650 | 0 | 4 | _aThermodynamics |
| 700 | 1 | _aCuya-Guizado, Teobaldo Ricardo | |
| 700 | 1 | _aPadilla-Chavarria, Helmut Isaac | |
| 700 | 1 | _aFrança, Tanos Celmar Costa | |
| 700 | 1 | _aPimentel, Andre Silva | |
| 773 | 0 |
_tJournal of molecular graphics & modelling _gvol. 62 _gp. 235-244 |
|
| 856 | 4 | 0 |
_uhttps://doi.org/10.1016/j.jmgm.2015.10.001 _zAvailable from publisher's website |
| 999 |
_c25406449 _d25406449 |
||