Table 1 Top 5 results for ColabFold and Rosetta.

From: A hybrid evolutionary and structural method for AI-guided peptide inhibitor design using AlphaFold and Rosetta

#

Generation

Sequence

Docking score (REU)

Avg. REU

Worst REU

Time (s)

Occupancy

ColabFold

1

84

AGVAKAKAV

− 634

− 525

− 96

10,104

79%

2

66

VKAKKCVI

− 633

− 518

− 133

8091

79%

3

59

VAKCCG

− 628

− 509

56

9019

79%

4

63

AAAKKVTKH

− 625

− 521

− 87

7974

79%

5

48

LAKFKIKH

− 621

− 516

12

44,824

77%

Rosetta

1

96

PGGHSCC

− 611

− 468

448

1672

70%

2

36

GMLELHQTYT

− 608

− 478

− 189

1765

70%

3

99

GSSSSSYGSGC

− 606

− 495

− 456

1693

67%

4

94

HQSHLSHGCL

− 605

− 486

− 428

1732

70%

5

8

TLILGTERELLESYI

− 602

− 470

− 271

1616

70%

  1. REU = Rosetta energy Unit, which was used as a Docking score.