| 000 | 01002 a2200253 4500 | ||
|---|---|---|---|
| 005 | 20250516040952.0 | ||
| 264 | 0 | _c20111018 | |
| 008 | 201110s 0 0 eng d | ||
| 022 | _a1520-5207 | ||
| 024 | 7 |
_a10.1021/jp201217b _2doi |
|
| 040 |
_aNLM _beng _cNLM |
||
| 100 | 1 | _aPlotnikov, Nikolay V | |
| 245 | 0 | 0 |
_aParadynamics: an effective and reliable model for ab initio QM/MM free-energy calculations and related tasks. _h[electronic resource] |
| 260 |
_bThe journal of physical chemistry. B _cJun 2011 |
||
| 300 |
_a7950-62 p. _bdigital |
||
| 500 | _aPublication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't | ||
| 650 | 0 | 4 | _aModels, Molecular |
| 650 | 0 | 4 | _aQuantum Theory |
| 650 | 0 | 4 | _aThermodynamics |
| 700 | 1 | _aKamerlin, Shina C L | |
| 700 | 1 | _aWarshel, Arieh | |
| 773 | 0 |
_tThe journal of physical chemistry. B _gvol. 115 _gno. 24 _gp. 7950-62 |
|
| 856 | 4 | 0 |
_uhttps://doi.org/10.1021/jp201217b _zAvailable from publisher's website |
| 999 |
_c20879398 _d20879398 |
||