| 000 | 01302 a2200361 4500 | ||
|---|---|---|---|
| 005 | 20250516032329.0 | ||
| 264 | 0 | _c20110824 | |
| 008 | 201108s 0 0 eng d | ||
| 022 | _a1096-987X | ||
| 024 | 7 |
_a10.1002/jcc.21775 _2doi |
|
| 040 |
_aNLM _beng _cNLM |
||
| 100 | 1 | _aLu, Shao-Yong | |
| 245 | 0 | 0 |
_aRole of bridging water molecules in GSK3β-inhibitor complexes: insights from QM/MM, MD, and molecular docking studies. _h[electronic resource] |
| 260 |
_bJournal of computational chemistry _cJul 2011 |
||
| 300 |
_a1907-18 p. _bdigital |
||
| 500 | _aPublication Type: Journal Article; Research Support, Non-U.S. Gov't | ||
| 650 | 0 | 4 | _aComputer Simulation |
| 650 | 0 | 4 | _aDrug Design |
| 650 | 0 | 4 |
_aGlycogen Synthase Kinase 3 _xantagonists & inhibitors |
| 650 | 0 | 4 | _aGlycogen Synthase Kinase 3 beta |
| 650 | 0 | 4 | _aHumans |
| 650 | 0 | 4 | _aModels, Molecular |
| 650 | 0 | 4 | _aProtein Binding |
| 650 | 0 | 4 |
_aProtein Kinase Inhibitors _xchemistry |
| 650 | 0 | 4 | _aQuantum Theory |
| 650 | 0 | 4 |
_aWater _xchemistry |
| 700 | 1 | _aJiang, Yong-Jun | |
| 700 | 1 | _aLv, Jing | |
| 700 | 1 | _aZou, Jian-Wei | |
| 700 | 1 | _aWu, Tian-Xing | |
| 773 | 0 |
_tJournal of computational chemistry _gvol. 32 _gno. 9 _gp. 1907-18 |
|
| 856 | 4 | 0 |
_uhttps://doi.org/10.1002/jcc.21775 _zAvailable from publisher's website |
| 999 |
_c20736558 _d20736558 |
||