PROJECT #16469 RESEARCH FOR CANCER
FOLDING PERFORMANCE PROFILE

PROJECT SUMMARY

Kinases are a major target for a variety of cancer therapies, but their mechanism of action is relatively unknown at a detailed atomic level, preventing us from understanding and optimizing known inhibitors. 

One example is the Serine/Threonine Kinase RIPK2. RIPK2 inhibition is useful for cancer targeting as it prevents RIPK2 from binding a protein partner named XIAP. In fact, there are already 3 known inhibitors that bind to RIPK2 and prevent RIPK2-XIAP binding! However, it remains difficult to optimize these ligands for clinical purposes because we do not understand how any of these three inhibitors actually act on RIPK2 to prevent XIAP binding behavior. 

These four projects are simulating RIPK2 by itself and bound to each of the three inhibitors, with the hope that this will reveal a more detailed mechanism of how each inhibitor works to prevent XIAP binding. As a bonus, this will help reveal how RIPK2 *binds* XIAP (also unknown)! 

PROJECT INFO

Manager(s): Sukrit Singh

Institution: Memorial Sloan-Kettering Cancer-Center

Project URL: http://sukritsingh.github.io/

PROJECT WORK UNIT SUMMARY

Atoms: 45,166

Core: OPENMM_22

Status: Public

PROJECT FOLDING PPD AVERAGES BY GPU

PPDDB data as of Tuesday, 26 October 2021 06:56:10

Rank
Project
Model Name
Folding@Home Identifier
Make
Brand
GPU
Model
PPD
Average
Points WU
Average
WUs Day
Average
WU Time
Average
1 GeForce RTX 3090
GA102 [GeForce RTX 3090]
Nvidia GA102 4,009,529 90,302 44.40 1 hrs 32 mins
2 GeForce RTX 3080 Ti
GA102 [GeForce RTX 3080 Ti]
Nvidia GA102 3,749,805 86,024 43.59 1 hrs 33 mins
3 GeForce RTX 3080 Lite Hash Rate
GA102 [GeForce RTX 3080 Lite Hash Rate]
Nvidia GA102 3,555,253 87,500 40.63 1 hrs 35 mins
4 GeForce RTX 3080
GA102 [GeForce RTX 3080]
Nvidia GA102 3,314,484 85,618 38.71 1 hrs 37 mins
5 GeForce RTX 2080 Ti Rev. A
TU102 [GeForce RTX 2080 Ti Rev. A] M 13448
Nvidia TU102 3,197,390 83,882 38.12 1 hrs 38 mins
6 GeForce RTX 3070 Ti
GA104 [GeForce RTX 3070 Ti]
Nvidia GA104 2,931,261 81,726 35.87 1 hrs 40 mins
7 GeForce RTX 2080 Ti
TU102 [GeForce RTX 2080 Ti] M 13448
Nvidia TU102 2,699,260 79,602 33.91 1 hrs 42 mins
8 GeForce RTX 3070
GA104 [GeForce RTX 3070]
Nvidia GA104 2,205,094 74,549 29.58 1 hrs 49 mins
9 TITAN Xp
GP102 [TITAN Xp] 12150
Nvidia GP102 2,191,908 74,787 29.31 1 hrs 49 mins
10 RTX A4000
GA104GL [RTX A4000]
Nvidia GA104GL 2,026,117 72,696 27.87 1 hrs 52 mins
11 GeForce RTX 2080 Super
TU104 [GeForce RTX 2080 SUPER]
Nvidia TU104 1,945,956 71,682 27.15 1 hrs 53 mins
12 GeForce RTX 2070 Rev. A
TU106 [GeForce RTX 2070 Rev. A] M 7465
Nvidia TU106 1,854,010 70,536 26.28 1 hrs 55 mins
13 GeForce RTX 2080 Rev. A
TU104 [GeForce RTX 2080 Rev. A] 10068
Nvidia TU104 1,757,896 69,273 25.38 1 hrs 57 mins
14 GeForce GTX 1080 Ti
GP102 [GeForce GTX 1080 Ti] 11380
Nvidia GP102 1,746,972 68,803 25.39 1 hrs 57 mins
15 GeForce RTX 3060 Ti Lite Hash Rate
GA104 [GeForce RTX 3060 Ti Lite Hash Rate]
Nvidia GA104 1,728,592 68,023 25.41 1 hrs 57 mins
16 GeForce RTX 2070 SUPER
TU104 [GeForce RTX 2070 SUPER] 8218
Nvidia TU104 1,724,906 68,692 25.11 1 hrs 57 mins
17 GeForce RTX 3060 Ti
GA104 [GeForce RTX 3060 Ti]
Nvidia GA104 1,702,292 68,505 24.85 1 hrs 58 mins
18 GeForce RTX 3070 Mobile / Max-Q 8GB/16GB
GA104M [GeForce RTX 3070 Mobile / Max-Q 8GB/16GB]
Nvidia GA104M 1,650,470 66,741 24.73 1 hrs 58 mins
19 GeForce RTX 2060
TU104 [GeForce RTX 2060]
Nvidia TU104 1,607,387 67,220 23.91 1 hrs 0 mins
20 GeForce RTX 2080
TU104 [GeForce RTX 2080]
Nvidia TU104 1,587,955 67,152 23.65 1 hrs 1 mins
21 Tesla P40
GP102GL [Tesla P40] 11760
Nvidia GP102GL 1,511,684 65,352 23.13 1 hrs 2 mins
22 GeForce RTX 2060 Super
TU106 [GeForce RTX 2060 SUPER]
Nvidia TU106 1,469,309 64,169 22.90 1 hrs 3 mins
23 TITAN X
GP102 [TITAN X] 6144
Nvidia GP102 1,374,118 63,649 21.59 1 hrs 7 mins
24 GeForce RTX 3060
GA106 [GeForce RTX 3060]
Nvidia GA106 1,350,754 63,755 21.19 1 hrs 8 mins
25 GeForce RTX 3060 Mobile / Max-Q
GA106M [GeForce RTX 3060 Mobile / Max-Q]
Nvidia GA106M 1,332,054 63,344 21.03 1 hrs 8 mins
26 GeForce RTX 2060
TU106 [Geforce RTX 2060]
Nvidia TU106 1,327,383 63,144 21.02 1 hrs 9 mins
27 GeForce GTX 1070 Ti
GP104 [GeForce GTX 1070 Ti] 8186
Nvidia GP104 1,099,511 59,666 18.43 1 hrs 18 mins
28 GeForce GTX 1070
GP104 [GeForce GTX 1070] 6463
Nvidia GP104 956,833 56,616 16.90 1 hrs 25 mins
29 GeForce GTX 1660 Ti
TU116 [GeForce GTX 1660 Ti]
Nvidia TU116 953,000 56,253 16.94 1 hrs 25 mins
30 GeForce RTX 2060 Mobile
TU106M [GeForce RTX 2060 Mobile]
Nvidia TU106M 918,790 56,012 16.40 1 hrs 28 mins
31 GeForce GTX 1660 SUPER
TU116 [GeForce GTX 1660 SUPER]
Nvidia TU116 912,881 55,127 16.56 1 hrs 27 mins
32 GeForce RTX 2070
TU106 [GeForce RTX 2070] M 6497
Nvidia TU106 872,105 51,849 16.82 1 hrs 26 mins
33 GeForce GTX 1660
TU116 [GeForce GTX 1660]
Nvidia TU116 837,254 54,242 15.44 2 hrs 33 mins
34 Tesla P4
GP104GL [Tesla P4] 5704
Nvidia GP104GL 642,884 48,695 13.20 2 hrs 49 mins
35 GeForce GTX 980
GM204 [GeForce GTX 980] 4612
Nvidia GM204 592,394 48,057 12.33 2 hrs 57 mins
36 GeForce GTX 1650 SUPER
TU116 [GeForce GTX 1650 SUPER]
Nvidia TU116 575,682 47,590 12.10 2 hrs 59 mins
37 GeForce GTX 1060 6GB
GP106 [GeForce GTX 1060 6GB] 4372
Nvidia GP106 479,075 43,058 11.13 2 hrs 9 mins
38 GeForce GTX 1650
TU117 [GeForce GTX 1650] 3091
Nvidia TU117 476,546 45,438 10.49 2 hrs 17 mins
39 GeForce GTX 970
GM204 [GeForce GTX 970] 3494
Nvidia GM204 420,139 42,965 9.78 2 hrs 27 mins
40 GeForce GTX 1080
GP104 [GeForce GTX 1080] 8873
Nvidia GP104 403,339 24,591 16.40 1 hrs 28 mins
41 Quadro T2000 Mobile / Max-Q
TU117GLM [Quadro T2000 Mobile / Max-Q]
Nvidia TU117GLM 378,190 41,893 9.03 3 hrs 40 mins
42 GeForce GTX 1650 Mobile / Max-Q
TU117M [GeForce GTX 1650 Mobile / Max-Q]
Nvidia TU117M 329,307 39,743 8.29 3 hrs 54 mins
43 P104-100
GP104 [P104-100]
Nvidia GP104 300,600 38,442 7.82 3 hrs 4 mins
44 GeForce GTX 1650
TU116 [GeForce GTX 1650] 2984
Nvidia TU116 296,814 39,856 7.45 3 hrs 13 mins
45 GeForce GTX 960
GM206 [GeForce GTX 960] 2308
Nvidia GM206 252,641 36,102 7.00 3 hrs 26 mins
46 P106-090
GP106 [P106-090]
Nvidia GP106 229,653 35,389 6.49 4 hrs 42 mins
47 GeForce GTX 950
GM206 [GeForce GTX 950] 1572
Nvidia GM206 185,750 32,035 5.80 4 hrs 8 mins
48 GeForce GTX 690
GK104 [GeForce GTX 690] 3130
Nvidia GK104 173,686 32,297 5.38 4 hrs 28 mins
49 GeForce GTX 660 Ti
GK104 [GeForce GTX 660 Ti] 2634
Nvidia GK104 158,632 28,992 5.47 4 hrs 23 mins
50 GeForce GTX 1050 Ti Mobile
GP107M [GeForce GTX 1050 Ti Mobile]
Nvidia GP107M 142,533 27,125 5.25 5 hrs 34 mins
51 Quadro P1000
GP107GL [Quadro P1000]
Nvidia GP107GL 110,680 27,454 4.03 6 hrs 57 mins
52 GeForce GT 1030
GP108 [GeForce GT 1030] 1127
Nvidia GP108 107,687 27,323 3.94 6 hrs 5 mins
53 Quadro K2200
GM107GL [Quadro K2200]
Nvidia GM107GL 104,114 27,173 3.83 6 hrs 16 mins
54 GeForce GTX 750 Ti
GM107 [GeForce GTX 750 Ti] 1389
Nvidia GM107 101,283 26,695 3.79 6 hrs 20 mins
55 Quadro K1200
GM107GL [Quadro K1200]
Nvidia GM107GL 71,769 23,928 3.00 8 hrs 0 mins
56 GeForce GTX 570 HD
GF110 [GeForce GTX 570 HD] 1405
Nvidia GF110 44,477 20,402 2.18 11 hrs 1 mins
57 GeForce GTX 960M
GM107 [GeForce GTX 960M] 1439
Nvidia GM107 18,457 7,211 2.56 9 hrs 23 mins

PROJECT FOLDING PPD AVERAGES BY CPU BETA

PPDDB data as of Tuesday, 26 October 2021 06:56:10

Rank
Project
CPU Model Logical
Processors (LP)
PPD-PLP
AVG PPD per 1 LP
ALL LP-PPD
(Estimated)
Make