CHARMM-GUI Nanomaterial Modeler for Modeling and Simulation of Nanomaterial Systems

Choi, YK; Kern, NR; Kim, S; Kanhaiya, K; Afshar, Y; Jeon, SH; Jo, S; Brooks, BR; Lee, J; Tadmor, EB; Heinz, H; Im, W

Im, W (通讯作者),Lehigh Univ, Dept Biol Sci, Bethlehem, PA 18015 USA.;Im, W (通讯作者),Lehigh Univ, Dept Comp Sci, Bethlehem, PA 18015 USA.;Im, W (通讯作者),Lehigh Univ, Dept Chem, Bethlehem, PA 18015 USA.;Im, W (通讯作者),Lehigh Univ, Dept Bioengn, Bethlehem, PA 18015 USA.;Im, W (通讯作者),Lehigh Univ, Dept Engn, Bethlehem, PA 18015 USA.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2022; 18 (1): 479