| 000 | 01219 a2200349 4500 | ||
|---|---|---|---|
| 005 | 20250518013704.0 | ||
| 264 | 0 | _c20190501 | |
| 008 | 201905s 0 0 eng d | ||
| 022 | _a1549-9626 | ||
| 024 | 7 |
_a10.1021/acs.jctc.8b00839 _2doi |
|
| 040 |
_aNLM _beng _cNLM |
||
| 100 | 1 | _aKhan, Hanif M | |
| 245 | 0 | 0 |
_aCation-π Interactions between Methylated Ammonium Groups and Tryptophan in the CHARMM36 Additive Force Field. _h[electronic resource] |
| 260 |
_bJournal of chemical theory and computation _cJan 2019 |
||
| 300 |
_a7-12 p. _bdigital |
||
| 500 | _aPublication Type: Journal Article | ||
| 650 | 0 | 4 |
_aAmmonium Compounds _xchemistry |
| 650 | 0 | 4 | _aCations |
| 650 | 0 | 4 |
_aCholine _xchemistry |
| 650 | 0 | 4 | _aDimerization |
| 650 | 0 | 4 |
_aLysine _xchemistry |
| 650 | 0 | 4 | _aMethylation |
| 650 | 0 | 4 |
_aProteins _xchemistry |
| 650 | 0 | 4 | _aQuantum Theory |
| 650 | 0 | 4 |
_aSolvents _xchemistry |
| 650 | 0 | 4 | _aThermodynamics |
| 650 | 0 | 4 |
_aTryptophan _xchemistry |
| 700 | 1 | _aMacKerell, Alexander D | |
| 700 | 1 | _aReuter, Nathalie | |
| 773 | 0 |
_tJournal of chemical theory and computation _gvol. 15 _gno. 1 _gp. 7-12 |
|
| 856 | 4 | 0 |
_uhttps://doi.org/10.1021/acs.jctc.8b00839 _zAvailable from publisher's website |
| 999 |
_c29174766 _d29174766 |
||