Search found 188 matches

by Samuel Flores
Sun Aug 12, 2018 2:00 am
Forum: MMB (formerly RNABuilder)
Topic: How to run MMB
Replies: 1
Views: 503

Re: How to run MMB

You need to run this in a terminal or console window.

Really I am not a fan of Windows. I recommend installing ubuntu on a USB and then downloading MMB 2.17.1 for Linux. You will find instructions in the tutorial guide for running it.

Sam
by Samuel Flores
Tue Dec 19, 2017 7:45 am
Forum: MMB (formerly RNABuilder)
Topic: Threading a double stranded RNA
Replies: 4
Views: 418

Re: Threading a double stranded RNA

Very well. here is the commands.dat you would use: firstStage 2 lastStage 2 # Initial -- "template" fragment loadSequencesFromPdb renumbered.txt # TP53 -- "target" fragment RNA B 1 UUAGGUACUAAGGUUCACCGGUGAACCUUAGUACCUAA # worry about steric clashes only in the loop. Elsewhere, the coordinates are ba...
by Samuel Flores
Tue Dec 19, 2017 6:05 am
Forum: MMB (formerly RNABuilder)
Topic: Threading a double stranded RNA
Replies: 4
Views: 418

Re: Threading a double stranded RNA

Ciao Martina, Firstly, I would strongly encourage you to use MMB 17.2, the latest release. I see you are using Windows, which would explain why you went with an old release. Do you have access to a mac or linux machine? It could be that the "mobilizer Rigid" command is not working properly. Hard for...
by Samuel Flores
Mon Aug 28, 2017 8:05 am
Forum: MMB (formerly RNABuilder)
Topic: Issue with DG, DG, WatsonCrick Hoogsteen base pair
Replies: 1
Views: 254

Re: Issue with DG, DG, WatsonCrick Hoogsteen base pair

Ack! Sorry I missed this. I was getting ready for my summer teaching, not that that is such a great excuse. Your first problem is that "Cis" should be capitalized. Sorry MMB is case-sensitive. I have not gotten around to making it case-insensitive. However the "Cis" thing alone is not enough. I actu...
by Samuel Flores
Sat Jun 17, 2017 3:00 pm
Forum: OpenMM
Topic: Compile openMM on an RPI
Replies: 5
Views: 277

Re: Compile openMM on an RPI

Hi Peter, it's a bit hard for third parties like myself to follow this. There are more than 10 million Pis in the world now, so I feel that it's not a bad platform to support. Why not put the right switches in CMakeLists to handle the case of the Pi? We would be happy to give you access to our raspb...
by Samuel Flores
Fri Jun 02, 2017 3:33 am
Forum: OpenMM
Topic: problem with undefined symbol
Replies: 1
Views: 151

problem with undefined symbol

Guys, I just upgraded to OS Sierra and am having some link issues. I was able to compile, using the flags : -std=c++14 -stdlib=libc++ , architecture x86_64 , deploying to OS 10.12 . The OpenMM tests pass. The problem is that when I link libOpenMM.dylib to my code, it tells me that the computeNeighbo...
by Samuel Flores
Fri Jun 02, 2017 2:54 am
Forum: Simbody: SimTK multibody dynamics API
Topic: ClonePtr.h issue
Replies: 4
Views: 414

Re: ClonePtr.h issue

Turns out it wanted me to set -stdlib=libc++ for some reason..

having some additional problems, but the above seems to be fixed now

thanks
sam
by Samuel Flores
Fri Jun 02, 2017 1:03 am
Forum: Simbody: SimTK multibody dynamics API
Topic: ClonePtr.h issue
Replies: 4
Views: 414

Re: ClonePtr.h issue

I did include it in my Utils.h: 21 #include <cstddef> 22 #include "SimTKsimbody.h" 23 #include "SimTKmolmodel.h" Based on your comment I also added it to ClonePtr.h , though I would think that would have come up before if that were the issue: 27 #include "SimTKcommon/internal/common.h" 28 29 #includ...
by Samuel Flores
Thu Jun 01, 2017 1:45 am
Forum: Simbody: SimTK multibody dynamics API
Topic: ClonePtr.h issue
Replies: 4
Views: 414

ClonePtr.h issue

Guys, I am now further along. Now when compiling MMB I am getting a hard error in ClonePtr.h, appended below. It seems like something that should have come up when I compiled simbody or molmodel, but those all compiled just fine. Thanks in advance for any advice. Sam nl110-99-73:build Sam$ /usr/bin/...
by Samuel Flores
Thu Jun 01, 2017 12:42 am
Forum: Simbody: SimTK multibody dynamics API
Topic: Can't figure out: binding dereferenced null pointer to reference has undefined behavior
Replies: 5
Views: 531

Re: Can't figure out: binding dereferenced null pointer to reference has undefined behavior

Good to know that's not the problem. I'll continue hacking. Should I be using -std=c++14 , on simbody, openmm, and molmodel?