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Source code
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moltiverse
v0.2.0
Top Level Namespace
Colvar
Component
RadiusOfGyration
RMSD
Windowed
Conformer
Enumerable
Ligand
Moltiverse
NAMD
Input
OpenBabel
CoordinateGenerationMode
SamplingProtocol
XTB
OptimizationLevel
Generated using Crystal 1.14.0
2024-12-20 10:10:56 UTC
module
NAMD
Defined in:
moltiverse/namd.cr
Class Method Summary
.run
(cfg : Path | String, *args, cores : Int =
System
.cpu_count, use_gpu : Bool =
false
, retries : Int =
1
, **options) : Bool
Class Method Detail
def self.
run
(cfg : Path | String, *args, cores : Int =
System
.cpu_count, use_gpu : Bool =
false
, retries : Int =
1
, **options) : Bool
#
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