Number of the records: 1
Metadynamics As a Tool for Mapping the Conformational and Free-Energy Space of Peptides - The Alanine Dipeptide Case Study
SYS 0351148 LBL 02070^^^^^2200301^^^450 005 20240103194304.5 014 $a 000276889100050 $2 WOS 017 $a 10.1021/jp100950w $2 DOI 100 $a 20110310d m y slo 03 ba 101 0-
$a eng $d eng 102 $a US 200 1-
$a Metadynamics As a Tool for Mapping the Conformational and Free-Energy Space of Peptides - The Alanine Dipeptide Case Study 215 $a 11 s. 463 -1
$1 001 cav_un_epca*0257919 $1 011 $a 1520-6106 $e 1520-5207 $1 200 1 $a Journal of Physical Chemistry B $v Roč. 114, č. 16 (2010), s. 5632-5642 $1 210 $c American Chemical Society 610 0-
$a metadynamics 610 0-
$a alanine dipeptide 610 0-
$a explicit water models 700 -1
$3 cav_un_auth*0244345 $a Vymětal $b Jiří $i Nekovalentní interakce $j Non-Covalent Interactions $k 610/61 $l 610/61 $p UOCHB-X $w Chemical biology for life and diseases $4 070 $T Ústav organické chemie a biochemie AV ČR, v. v. i. 701 -1
$3 cav_un_auth*0103743 $a Vondrášek $b Jiří $i Nekovalentní interakce $j Non-Covalent Interactions $k 610/61 $l 610/61 $p UOCHB-X $w Chemical biology for life and diseases $z G $4 070 $T Ústav organické chemie a biochemie AV ČR, v. v. i.
Number of the records: 1