Počet záznamů: 1
Effects of micro-hydration in proton transfer from H2S.NO+ complex to water: ab initio and molecular dynamics study
SYS 0359349 LBL 01448^^^^^2200349^^^450 005 20240103195143.9 014 $a 000290280100015 $2 WOS 017 $a 10.1135/cccc2011047 $2 DOI 100 $a 20110524d m y slo 03 ba 101 0-
$a eng $d eng 102 $a CZ 200 1-
$a Effects of micro-hydration in proton transfer from H2S.NO+ complex to water: ab initio and molecular dynamics study 215 $a 18 s. 300 $a MSM4781305903 463 -1
$1 001 cav_un_epca*0256425 $1 011 $a 0010-0765 $1 200 1 $a Collection of Czechoslovak Chemical Communications $v Roč. 76, č. 5 (2011), s. 585-603 $1 210 $c Ústav organické chemie a biochemie AV ČR, v. v. i. 610 0-
$a proton transfer 610 0-
$a water clusters 610 0-
$a ab initio molecular dynamics. 700 -1
$3 cav_un_auth*0244537 $a Černušák $b I. $y SK $4 070 701 -1
$3 cav_un_auth*0271879 $a Federič $b J. $y SK $4 070 701 -1
$3 cav_un_auth*0107584 $a Jungwirth $b Pavel $i Molekulové modelování $j Molecular Modeling $k 630/63 $l 630/63 $p UOCHB-X $w Molecular modeling and spectroscopy in chemistry and biology $z G $4 070 $T Ústav organické chemie a biochemie AV ČR, v. v. i. 701 -1
$3 cav_un_auth*0271880 $a Uhlár $b M. $y CZ $4 070
Počet záznamů: 1