Search found 228 matches

by vvoelz
Wed Jun 07, 2023 10:14 pm
Forum: Announcements - Folding Consortium
Topic: p12424 to FAH (GPU, OpenMM22)
Replies: 0
Views: 35805

p12424 to FAH (GPU, OpenMM22)

The Voelz lab is releasing a new GPU project, aimed at understanding the conformational dynamics of dimers of an enzyme called PTPσ. It's almost a half-million atoms so be aware of the large download. Happy folding! See also: https://stats.foldingathome.org/project/12424 Project 12424 <atoms v=“4384...
by vvoelz
Sun Jan 22, 2023 11:12 pm
Forum: Announcements - Folding Consortium
Topic: [CPU] Projects 18465-18466 to FAH
Replies: 0
Views: 3420

[CPU] Projects 18465-18466 to FAH

Projects 18465 and 18466 are expanded-ensemble (EE) simulations we are performing to predict water/toluene partition coefficients of small-molecule drugs as part of the recent SAMPL9 logP challenge. See: https://stats.foldingathome.org/project/18465 <project type="GRO_A8" id="18465&qu...
by vvoelz
Wed Nov 03, 2021 7:33 pm
Forum: Announcements - Folding Consortium
Topic: releasing new CPU (GRO_A8) project 18436 to FAH
Replies: 0
Views: 5780

releasing new CPU (GRO_A8) project 18436 to FAH

We are releasing new CPU (GRO_A8) project 18436 to FAH project 18436 <atoms v="8500"/> <stats_credit v="1825"/> Timeout of 2.0 days and a deadline of 3.5 days Project description: https://apps.foldingathome.org/project?p=18436 These projects have an nCPU<=8 filter (they are less ...
by vvoelz
Tue Oct 19, 2021 2:47 pm
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) project 18435 to FAH
Replies: 0
Views: 5447

CPU (GRO_A8) project 18435 to FAH

We have released new CPU (GRO_A8) project 18435 to FAH <atoms v="8500"/> <stats_credit v="1825"/> Timeout of 2.0 days and a deadline of 3.5 days Project description: https://apps.foldingathome.org/project?p=18433 These projects are designed to help us test our ability to predict ...
by vvoelz
Fri Oct 15, 2021 1:48 am
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) projects 18433, 18434 to released to FAH
Replies: 0
Views: 6007

CPU (GRO_A8) projects 18433, 18434 to released to FAH

New CPU (GRO_A8) projects 18433, 18434 released to FAH 18433 <atoms v="8500"/> <stats_credit v="5400"/> 18434 <atoms v="4091"/> <stats_credit v="2460"/> Both projects have timeout of 2.0 days and a deadline of 3.5 days, and a nCPU<=8 filter (they are smaller, ...
by vvoelz
Mon Oct 04, 2021 10:13 pm
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) Project 18430 released to FAH
Replies: 0
Views: 5804

CPU (GRO_A8) Project 18430 released to FAH

We are releasing new CPU (GRO_A8) project 18430

<atoms v="6650"/>
<stats_credit v="1380"/>
<timeout v="2.0"/>
<deadline v="3.5"/>

Projects description:
https://apps.foldingathome.org/project?p=18430

Thanks!
by vvoelz
Wed Aug 25, 2021 3:26 pm
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) project 16977 to FAH
Replies: 0
Views: 6129

CPU (GRO_A8) project 16977 to FAH

We are releasing new CPU (GRO_A8) project 16977 to FAH
Project description here: https://stats.foldingathome.org/project?p=16977

<project type="GRO_A8" id="16977">
<stats_credit v="3400"/>
<timeout v="3.0"/>
<deadline v="5.0"/>
by vvoelz
Fri May 07, 2021 5:56 pm
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) project 16969 to FAH
Replies: 0
Views: 6733

CPU (GRO_A8) project 16969 to FAH

We're releasing a new project to FAH on machines with nCPUs >= 4: Project description here: https://stats.foldingathome.org/project?p=16969 <project type="GRO_A8" id="16969"> <stats_credit v="8368"/> <timeout v="3.0"/> <deadline v="5.0"/>
by vvoelz
Thu Apr 01, 2021 4:07 pm
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) project 16959 to FAH
Replies: 0
Views: 5377

CPU (GRO_A8) project 16959 to FAH

We're releasing a new project to FAH on machines with nCPUs >= 4: Project description here: https://stats.foldingathome.org/project?p=16959 <project type="GRO_A8" id="16959"> <stats_credit v="8368"/> <timeout v="3.0"/> <deadline v="5.0"/>
by vvoelz
Sun Mar 28, 2021 2:42 pm
Forum: Announcements - Folding Consortium
Topic: CPU (GRO_A8) project 16955 to FAH
Replies: 0
Views: 4871

CPU (GRO_A8) project 16955 to FAH

Releasing CPU (GRO_A8) project 16955 to FAH This project simulates human enzyme lactate dehydrogenase (LDH) Project description here: https://stats.foldingathome.org/project?p=16955 <project type="GRO_A8" id="16955"> <stats_credit v="4040"/> <timeout v="3.0"/>...
by vvoelz
Fri Feb 26, 2021 6:01 pm
Forum: Issues with a specific WU
Topic: 155.247.166.219 sent 1.5 year old WU [Project 14188]
Replies: 25
Views: 20822

Re: 155.247.166.219 sent 1.5 year old WU [Project 14188]

Thanks everybody for reporting these. We are having problems with this machine right now (it is currently *down*) and we are trying to get it back up soon. --VInce
by vvoelz
Sat Nov 28, 2020 2:33 pm
Forum: Announcements - Folding Consortium
Topic: new [CPU, GRO_A7] p16927 released to FAH
Replies: 0
Views: 1361

new [CPU, GRO_A7] p16927 released to FAH

The following CPU (GRO_A7 core) project p16927 is now released on FAH

Project: 16927
Description: https://stats.foldingathome.org/project?p=16927
stats credit: 1360
timeout: 2 days
deadline 20 days
number of atoms: 127200
by vvoelz
Wed Nov 04, 2020 5:08 am
Forum: Announcements - Folding Consortium
Topic: p16926 (CPU, A8) released to FAH
Replies: 0
Views: 1233

p16926 (CPU, A8) released to FAH

Description: This is a VERY small (~1300 atoms) tetraalanine peptide whose simulation will be useful for testing new adaptive sampling methods. Because of its size, it's limited to nCPU <= 10. Project description here: https://apps.foldingathome.org/project?p=16926 This new project utilizes one of t...
by vvoelz
Wed Oct 28, 2020 10:03 pm
Forum: Announcements - Folding Consortium
Topic: project 16925 (CPU, A7) on FAH
Replies: 0
Views: 1325

project 16925 (CPU, A7) on FAH

This project is an extremophilic enzyme from Antarctica
Project description here: https://apps.foldingathome.org/project?p=16925

project number: 16925
<atoms v="127200"/>
<stats_credit v="1360"/>
<timeout v="15.0"/>
<deadline v="20.0"/>
by vvoelz
Fri Jul 03, 2020 10:29 am
Forum: Issues with a specific server
Topic: 155.247.166.220 downloads stalled
Replies: 98
Views: 16689

Re: 155.247.166.220 downloads stalled

Thanks Sparkly -- I'll pass that on to our IT folks