desolvate¶
single-shot desolvation (no inheritance)
Single-valued attributes:
psf: name of input PSF file
pdb: name of input PDB file (optional)
keepatselstr: VMD atomselect string for atoms you want to keep (default: protein or lipid or glycan)
idx_outfile: name of output index file for catdcd (default: dry.idx)
psf_outfile: name of output PSF file (default: dry.psf)
dcd_outfile: name of output DCD file (default: dry.dcd)
dcd_infiles: ordered list of names of input DCD files
dcd_stride: stride for output DCD file (default: 1)