|
|
|
|
| LEADER |
01000naa a22002652 4500 |
| 001 |
NLM243567189 |
| 003 |
DE-627 |
| 005 |
20231224132813.0 |
| 007 |
cr uuu---uuuuu |
| 008 |
231224s1996 xx |||||o 00| ||eng c |
| 024 |
7 |
|
|a 10.1002/(SICI)1096-987X(199608)17:11<1344::AID-JCC7>3.0.CO;2-M
|2 doi
|
| 028 |
5 |
2 |
|a pubmed24n0811.xml
|
| 035 |
|
|
|a (DE-627)NLM243567189
|
| 035 |
|
|
|a (NLM)25400153
|
| 040 |
|
|
|a DE-627
|b ger
|c DE-627
|e rakwb
|
| 041 |
|
|
|a eng
|
| 100 |
1 |
|
|a Zhou, Z
|e verfasserin
|4 aut
|
| 245 |
1 |
0 |
|a Finite-difference solution of the Poisson-Boltzmann equation
|b Complete elimination of self-energy
|
| 264 |
|
1 |
|c 1996
|
| 336 |
|
|
|a Text
|b txt
|2 rdacontent
|
| 337 |
|
|
|a ƒaComputermedien
|b c
|2 rdamedia
|
| 338 |
|
|
|a ƒa Online-Ressource
|b cr
|2 rdacarrier
|
| 500 |
|
|
|a Date Completed 18.11.2014
|
| 500 |
|
|
|a Date Revised 17.11.2014
|
| 500 |
|
|
|a published: Print
|
| 500 |
|
|
|a Citation Status PubMed-not-MEDLINE
|
| 520 |
|
|
|a Copyright © 1996 John Wiley & Sons, Inc.
|
| 520 |
|
|
|a A new procedure to solve the Poisson-Boltzmann equation is proposed and shown to be efficient. The electrostatic potential due to the reaction field is calculated directly. Self-interactions among the charges are completely eliminated. Therefore, the reference calculation to cancel out the self-energy is not needed. © 1996 by John Wiley & Sons, Inc
|
| 650 |
|
4 |
|a Journal Article
|
| 700 |
1 |
|
|a Payne, P
|e verfasserin
|4 aut
|
| 700 |
1 |
|
|a Vasquez, M
|e verfasserin
|4 aut
|
| 700 |
1 |
|
|a Kuhn, N
|e verfasserin
|4 aut
|
| 700 |
1 |
|
|a Levitt, M
|e verfasserin
|4 aut
|
| 773 |
0 |
8 |
|i Enthalten in
|t Journal of computational chemistry
|d 1984
|g 17(1996), 11 vom: 17. Aug., Seite 1344-51
|w (DE-627)NLM098138448
|x 1096-987X
|7 nnns
|
| 773 |
1 |
8 |
|g volume:17
|g year:1996
|g number:11
|g day:17
|g month:08
|g pages:1344-51
|
| 856 |
4 |
0 |
|u http://dx.doi.org/10.1002/(SICI)1096-987X(199608)17:11<1344::AID-JCC7>3.0.CO;2-M
|3 Volltext
|
| 912 |
|
|
|a GBV_USEFLAG_A
|
| 912 |
|
|
|a SYSFLAG_A
|
| 912 |
|
|
|a GBV_NLM
|
| 912 |
|
|
|a GBV_ILN_350
|
| 951 |
|
|
|a AR
|
| 952 |
|
|
|d 17
|j 1996
|e 11
|b 17
|c 08
|h 1344-51
|