PuSH - HMGU Publikationen https://push-zb.helmholtz-munich.de PuSH - Publikationen-Server des Helmholtz Zentrums München de-de <![CDATA[Marcisz, M.* et al. Explicit solvent repulsive scaling replica exchange molecular dynamics (RS-REMD) in molecular modeling of protein-glycosaminoglycan complexes. J. Comput. Chem. 43, 1633-1640 (2022)]]> https://push-zb.helmholtz-munich.de/frontdoor.php?source_opus=65629&la=de https://push-zb.helmholtz-munich.de/frontdoor.php?source_opus=65629&la=de Thu, 29 Sep 2022 00:00:00 +0000 <![CDATA[Hahnke, V.* ; Rupp, M. ; Krier, M.* ; Rippmann, F.* & Schneider, G.* Pharmacophorealignment search tool: Influence of canonical atom labeling on similarity searching. J. Comput. Chem. 31, 2810-2826 (2010)]]> https://push-zb.helmholtz-munich.de/frontdoor.php?source_opus=6140&la=de https://push-zb.helmholtz-munich.de/frontdoor.php?source_opus=6140&la=de Fri, 31 Dec 2010 00:00:00 +0000