Table 2. Average R_g Obtained for CG Models of the Benchmark Optimized Using Execution Mode 1 and Swarm-CG Default Settings, the Reference AA-Mapped Trajectories and Manually Parameterized CG Models from the Literature^a.

		radius of gyration (Rg)
molecule	bond scaling	ref. AA model [Å]	optimized CG model error [ΔÅ] (Δ%)	manually parametrized CG model error [ΔÅ] (Δ%)	optimization wall timeb (h)
BTA	++	9.07	0.37 (4.1%)	0.41 (4.5%)83	6
BTT	++	8.45	0.73 (8.6%)	0.89 (10.5%)84	7
NDI	+++	10.98	0.53 (4.8%)	0.75 (6.8%)47	16.5
porphyrin	++	13.58	0.40 (3.0%)	0.60 (4.4%)50	15.5
β-cyclodextrin	n/a	5.71	0.15 (2.6%)	0.35 (6.1%)97	5
pillar[5]arene	+	6.43	0.07 (1.1%)	n/a	6.5
spermine dendron	+	9.50	0.27 (2.8%)	n/a	12
PAMAM G1	n/a	9.95	0.12 (1.2%)	2.62 (26.3%)49	5
PAMAM G2	n/a	13.61	1.26 (9.3%)	3.32 (24.4%)49	5.5

^aAll data points were obtained in 200 ns simulations. (+) Minimal bond rescaling. (++) Important bond rescaling. (+++) All bonds rescaled.

^bUsing standard desktop machines, see Supporting Information and Table S2 for simulations parameters and hardware specifications.