PROJECT #16468 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: 45,128

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 3,929,041 88,966 44.16 1 hrs 33 mins
2 GeForce RTX 3080 Ti
GA102 [GeForce RTX 3080 Ti]
Nvidia GA102 3,665,075 85,012 43.11 1 hrs 33 mins
3 GeForce RTX 3080 Lite Hash Rate
GA102 [GeForce RTX 3080 Lite Hash Rate]
Nvidia GA102 3,431,587 85,352 40.21 1 hrs 36 mins
4 GeForce RTX 3080
GA102 [GeForce RTX 3080]
Nvidia GA102 3,179,651 83,338 38.15 1 hrs 38 mins
5 GeForce RTX 2080 Ti Rev. A
TU102 [GeForce RTX 2080 Ti Rev. A] M 13448
Nvidia TU102 3,016,702 81,483 37.02 1 hrs 39 mins
6 GeForce RTX 3070 Ti
GA104 [GeForce RTX 3070 Ti]
Nvidia GA104 2,720,355 79,119 34.38 1 hrs 42 mins
7 GeForce RTX 2080 Ti
TU102 [GeForce RTX 2080 Ti] M 13448
Nvidia TU102 2,425,816 75,874 31.97 1 hrs 45 mins
8 GeForce RTX 3070
GA104 [GeForce RTX 3070]
Nvidia GA104 2,181,457 73,578 29.65 1 hrs 49 mins
9 TITAN Xp
GP102 [TITAN Xp] 12150
Nvidia GP102 2,113,472 72,915 28.99 1 hrs 50 mins
10 GeForce RTX 2080 Super
TU104 [GeForce RTX 2080 SUPER]
Nvidia TU104 1,871,527 70,107 26.70 1 hrs 54 mins
11 GeForce RTX 2070 Rev. A
TU106 [GeForce RTX 2070 Rev. A] M 7465
Nvidia TU106 1,828,337 69,414 26.34 1 hrs 55 mins
12 GeForce RTX 2070 SUPER
TU104 [GeForce RTX 2070 SUPER] 8218
Nvidia TU104 1,798,113 68,575 26.22 1 hrs 55 mins
13 GeForce GTX 1080 Ti
GP102 [GeForce GTX 1080 Ti] 11380
Nvidia GP102 1,770,064 68,747 25.75 1 hrs 56 mins
14 GeForce RTX 2080 Rev. A
TU104 [GeForce RTX 2080 Rev. A] 10068
Nvidia TU104 1,729,626 68,147 25.38 1 hrs 57 mins
15 GeForce RTX 2080
TU104 [GeForce RTX 2080]
Nvidia TU104 1,668,118 67,402 24.75 1 hrs 58 mins
16 GeForce RTX 3060 Ti
GA104 [GeForce RTX 3060 Ti]
Nvidia GA104 1,632,547 66,589 24.52 1 hrs 59 mins
17 GeForce RTX 2060
TU104 [GeForce RTX 2060]
Nvidia TU104 1,629,485 66,123 24.64 1 hrs 58 mins
18 GeForce RTX 3060 Ti Lite Hash Rate
GA104 [GeForce RTX 3060 Ti Lite Hash Rate]
Nvidia GA104 1,619,567 66,740 24.27 1 hrs 59 mins
19 GeForce RTX 2060 Super
TU106 [GeForce RTX 2060 SUPER]
Nvidia TU106 1,479,205 64,125 23.07 1 hrs 2 mins
20 Tesla P40
GP102GL [Tesla P40] 11760
Nvidia GP102GL 1,475,709 64,176 22.99 1 hrs 3 mins
21 TITAN X
GP102 [TITAN X] 6144
Nvidia GP102 1,374,720 62,914 21.85 1 hrs 6 mins
22 GeForce RTX 3070 Mobile / Max-Q 8GB/16GB
GA104M [GeForce RTX 3070 Mobile / Max-Q 8GB/16GB]
Nvidia GA104M 1,331,108 62,082 21.44 1 hrs 7 mins
23 GeForce RTX 2060
TU106 [Geforce RTX 2060]
Nvidia TU106 1,321,536 62,276 21.22 1 hrs 8 mins
24 GeForce RTX 3060
GA106 [GeForce RTX 3060]
Nvidia GA106 1,277,450 62,066 20.58 1 hrs 10 mins
25 GeForce RTX 2070
TU106 [GeForce RTX 2070] M 6497
Nvidia TU106 1,274,312 57,036 22.34 1 hrs 4 mins
26 Quadro P5000
GP104GL [Quadro P5000]
Nvidia GP104GL 1,108,630 59,024 18.78 1 hrs 17 mins
27 GeForce GTX 1070
GP104 [GeForce GTX 1070] 6463
Nvidia GP104 977,223 56,380 17.33 1 hrs 23 mins
28 GeForce RTX 2060 Mobile
TU106M [GeForce RTX 2060 Mobile]
Nvidia TU106M 951,463 56,125 16.95 1 hrs 25 mins
29 GeForce GTX 1660 Ti
TU116 [GeForce GTX 1660 Ti]
Nvidia TU116 917,497 55,196 16.62 1 hrs 27 mins
30 GeForce GTX 1660 SUPER
TU116 [GeForce GTX 1660 SUPER]
Nvidia TU116 901,870 54,337 16.60 1 hrs 27 mins
31 GeForce GTX 1080
GP104 [GeForce GTX 1080] 8873
Nvidia GP104 860,113 49,945 17.22 1 hrs 24 mins
32 GeForce GTX 1070 Ti
GP104 [GeForce GTX 1070 Ti] 8186
Nvidia GP104 855,413 53,080 16.12 1 hrs 29 mins
33 Tesla P4
GP104GL [Tesla P4] 5704
Nvidia GP104GL 648,764 49,158 13.20 2 hrs 49 mins
34 GeForce GTX 1660
TU116 [GeForce GTX 1660]
Nvidia TU116 640,514 49,036 13.06 2 hrs 50 mins
35 GeForce GTX 980
GM204 [GeForce GTX 980] 4612
Nvidia GM204 584,662 47,741 12.25 2 hrs 58 mins
36 GeForce GTX 1650 SUPER
TU116 [GeForce GTX 1650 SUPER]
Nvidia TU116 557,356 46,809 11.91 2 hrs 1 mins
37 GeForce GTX 1060 6GB
GP106 [GeForce GTX 1060 6GB] 4372
Nvidia GP106 494,704 44,952 11.01 2 hrs 11 mins
38 GeForce GTX 1060 3GB
GP106 [GeForce GTX 1060 3GB] 3935
Nvidia GP106 489,368 44,893 10.90 2 hrs 12 mins
39 GeForce GTX 1650
TU117 [GeForce GTX 1650] 3091
Nvidia TU117 474,147 44,549 10.64 2 hrs 15 mins
40 GeForce GTX 970
GM204 [GeForce GTX 970] 3494
Nvidia GM204 401,072 41,930 9.57 3 hrs 31 mins
41 Quadro T2000 Mobile / Max-Q
TU117GLM [Quadro T2000 Mobile / Max-Q]
Nvidia TU117GLM 369,653 41,179 8.98 3 hrs 40 mins
42 GeForce GTX 1650 Mobile / Max-Q
TU117M [GeForce GTX 1650 Mobile / Max-Q]
Nvidia TU117M 345,792 39,384 8.78 3 hrs 44 mins
43 P104-100
GP104 [P104-100]
Nvidia GP104 296,974 38,037 7.81 3 hrs 4 mins
44 GeForce GTX 960
GM206 [GeForce GTX 960] 2308
Nvidia GM206 283,809 37,577 7.55 3 hrs 11 mins
45 P106-100
GP106 [P106-100]
Nvidia GP106 226,950 34,709 6.54 4 hrs 40 mins
46 P106-090
GP106 [P106-090]
Nvidia GP106 224,913 34,398 6.54 4 hrs 40 mins
47 GeForce GTX 950
GM206 [GeForce GTX 950] 1572
Nvidia GM206 185,824 31,956 5.81 4 hrs 8 mins
48 GeForce GTX 690
GK104 [GeForce GTX 690] 3130
Nvidia GK104 173,917 31,987 5.44 4 hrs 25 mins
49 GeForce GTX 1050 Ti Mobile
GP107M [GeForce GTX 1050 Ti Mobile]
Nvidia GP107M 169,763 31,521 5.39 4 hrs 27 mins
50 GeForce GTX 660 Ti
GK104 [GeForce GTX 660 Ti] 2634
Nvidia GK104 144,568 29,375 4.92 5 hrs 53 mins
51 Quadro K4200
GK104 [Quadro K4200]
Nvidia GK104 125,261 28,416 4.41 5 hrs 27 mins
52 GeForce GTX 750 Ti
GM107 [GeForce GTX 750 Ti] 1389
Nvidia GM107 105,586 26,790 3.94 6 hrs 5 mins
53 Quadro K2200
GM107GL [Quadro K2200]
Nvidia GM107GL 101,891 26,583 3.83 6 hrs 16 mins
54 GeForce GTX 960M
GM107 [GeForce GTX 960M] 1439
Nvidia GM107 98,535 26,515 3.72 6 hrs 27 mins
55 Quadro P620
GP107GL [Quadro P620]
Nvidia GP107GL 93,955 25,973 3.62 7 hrs 38 mins
56 GeForce GT 1030
GP108 [GeForce GT 1030] 1127
Nvidia GP108 50,295 20,365 2.47 10 hrs 43 mins
57 GeForce GTX 560
GF114 [GeForce GTX 560]
Nvidia GF114 10,687 7,112 1.50 16 hrs 58 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