similar to: how to download pdb structure files?

Displaying 20 results from an estimated 2000 matches similar to: "how to download pdb structure files?"

2007 Mar 22
3
"digits" doesn't work in format function
Dear All, I was trying to format a numeric vector (100*1) by using outd <- format(x=m, sci=F, digits=2) > outd[1:10] [1] " 0.01787758" "-0.14760306" "-0.45806041" "-0.67858525" "-0.64591748" [6] "-0.05918100" "-0.25632276" "-0.15980138" "-0.08359873" "-0.37866688" >m[1:10] [1]
2012 Oct 10
2
lm on matrix data
Hi, I have a question about using lm on matrix, have to admit it is very trivial but I just couldn't find the answer after searched the mailing list and other online tutorial. It would be great if you could help. I have a matrix "trainx" of 492(rows) by 220(columns) that is my x, and trainy is 492 by 1. Also, I have the newdata testx which is 240 (rows) by 220 (columns). Here is
2010 Nov 30
5
how to know if a file exists on a remote server?
Hi, I'd like to download some data files from a remote server, the problem here is that some of the files actually don't exist, which I don't know before try. Just wondering if a function in R could tell me if a file exists on a remote server? I searched this mailing list and after read severals mails, still clueless. Any help will be highly appreciated. B.C.
2011 May 16
2
about spearman and kendal correlation coefficient calculation in "cor"
Hi, I have the following two measurements stored in mat: > print(mat) [,1] [,2] [1,] -14.80976 -265.786 [2,] -14.92417 -54.724 [3,] -13.92087 -58.912 [4,] -9.11503 -115.580 [5,] -17.05970 -278.749 [6,] -25.23313 -219.513 [7,] -19.62465 -497.873 [8,] -13.92087 -659.486 [9,] -14.24629 -131.680 [10,] -20.81758 -604.961 [11,] -15.32194 -18.735 To calculate the ranking
2012 Nov 27
2
in par(mfrow=c(1, 2)), how to keep one half plot static and the other half changing
Hi, I'm trying to plot something in the following way and would like if you could help: I'd like in a same plot window, two plots are shown, the left one is a bird-view plot of the whole data, the right half keep changing, i.e., different plots will be shown up on request, so that when I select/click on some where in the left plot, the right plot will be the corresponding plot. What I
2010 Dec 06
1
use pcls to solve least square fitting with constraints
Hi, I have a least square fitting problem with linear inequality constraints. pcls seems capable of solving it so I tried it, unfortunately, it is stuck with the following error: > M <- list() > M$y = Dmat[,1] > M$X = Cmat > M$Ain = as.matrix(Amat) > M$bin = rep(0, dim(Amat)[1]) > M$p=qr.solve(as.matrix(Cmat), Dmat[,1]) > M$w = rep(1, length(M$y)) > M$C = matrix(0,0,0)
2005 Jul 22
2
about nnet package
Dear All, I'm learning to train a neural network with my training data by using nnet package, then evaluate it with a evaluation set. My problem here is that, I need the trained network to be used in future, so, what should I store? and How? Any other options other than nnet package? Any example will be highly appreciated! Best, Baoqiang Cao
2006 Nov 08
2
interprete wilcox.test results
Dear All, I am using wilcox.test to test two samples, data_a and data_b, earch sample has 3 replicates, suppose data_a and data_b are 20*3 matrix. Then I used the following to test the null hypothesis (they are from same distribution.): wilcox.test(x=data_a, y=data_b, alternative="g") I got pvalue = 1.90806170863311e-09. When I switched data_a and data_b by doing the following:
2006 Apr 18
4
how to change legend size in a figure
Dear All, I am producing a figure with many curves on it. How do I make the legends for all those curves smaller so that it can fit the figure itself? The commands I used for ploting are: plot(x1,y1,col=1,lty=1) lines(x2,y2,col=2,lty=2) ... legend(0.3,0.4,c("name1","name2",...),col=1:20,lty=1:20) Any tips for making the legend fit the figure will very welcome! Thanks! Best,
2006 Mar 29
6
which function to use to do classification
Dear All, I have a data, suppose it is an N*M matrix data. All I want is to classify it into, let see, 3 classes. Which method(s) do you think is(are) appropriate for this purpose? Any reference will be welcome! Thanks! Best, Baoqiang Cao
2005 Sep 15
2
about cutree
Hi Everyone, I'm trying to use cutree to get the clusters after hclust. What I used is: mycluster<-cutree(cnclust,h=0.5) Now, my problem is, how can I get the actual clusters? Thanks! Best, Baoqiang Cao
2005 Jul 13
1
any reference to get started clustering
Dear All, Just start to use the long expected R, my focus will be doing clustering on microarray data, just wonder, anyone can show me any references to conquer the steep learning curve? Thanks! Best regards, Baoqiang Cao
2005 Jul 22
2
setting weights for such a two-class problem in nnet and svm
Dear All, I have such a two-class problem, one class is very large(~98% of total), and the other is just 2%. According to manual of nnet, I need setup "weights", so I intend to set 1 for class one, 49 for class 2. How do I do that? Just weights=49? Meanwhile I'd like to try svm(e1071), again, how do I setup "class.weights"? Thanks. BTW: Many thanks to Jake and Uwe for
2005 Jul 27
1
how to get actual value from predict in nnet?
Dear All, After followed the help of nnet, I could get the networks trained and, excitedly, get the prediction for other samples. It is a two classes data set, I used "N" and "P" to label the two. My question is, how do I get the predicted numerical value for each sample? Not just give me the label(either "N" or "P")? Thanks! FYI: The nnet example I
2006 Jun 21
4
help on ploting various lines
Dear All, I tried to plot a variety of lines(curves) on same figure. What I did is, plot(x=x1,y=y1) lines(x=x2,y=y2) lines(x=x3,y=y3) ... In my data, the maximum of y1 is much smaller than those maximums of other y vectors. So, in the figure I got, there are some curves which are not complete, I mean, they were cut off at the maximum of y1 at the y axis. Could anybody point out some right
2005 Jul 22
0
setting weights for such a two-class problem in nnet andsvm
======= At 2005-07-22, 12:56:12 you wrote: ======= >On Fri, 22 Jul 2005, Baoqiang Cao wrote: > >> Dear All, >> >> I have such a two-class problem, one class is very large(~98% of total), >> and the other is just 2%. According to manual of nnet, I need setup >> "weights", so I intend to set 1 for class one, 49 for class 2. How do I >> do that?
2005 Sep 09
0
usage of the trianed networks by nnet without R enviromen t
One possibility is to look at predict.nnet(), and - Write an R function that write out parts of an nnet object that are needed by predict.nnet() to an external file. - Re-write predict.nnet() in C, reading the model information from the external file. Obviously you'll also need the C source for the code that predict.nnet() calls, and modify those as needed to strip out dependency on R, if
2006 Oct 06
2
hist plot
Hi there, I really couldn't find out how to plot histogram with point/line instead of rectangle for each bin? Any help please? Thanks! Best, -Cao
2018 Mar 14
0
[PDB] [JIT] Write to PDB file when COFFObjectFile is emitted by JIT
Hi, thanks for the answers, i tried to use LINK.EXE to produce a pdb, but unfortunately, it produces an empty pdb (i have debug symbols in the dumped .obj because I can see them with PEViewer). It is probably because i have undefined symbols, which is logical because i'm dumping machine code which points to running native code. I still dont understand why LINK.EXE is not able to produce a
2018 Mar 14
1
[PDB] [JIT] Write to PDB file when COFFObjectFile is emitted by JIT
I'm sorry but I don't think I understand the question. But if you can't produce a pdb using MSVC, it is hard to imagine that only lld can do, unless MSVC linker has a bug. On Wed, Mar 14, 2018 at 3:07 PM Vivien Millet <vivien.millet at gmail.com> wrote: > Hi, thanks for the answers, i tried to use LINK.EXE to produce a pdb, but > unfortunately, it produces an empty pdb