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ChemmineR
•
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0
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329
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Comparing compounds in CheminneR
Cheminformatics
ChemmineR
ChemmineDrugs
10 months ago
Sean
• 0
0
votes
1
reply
875
views
ChemmineOB expects libopenbabel.7.dylib but latest OpenBabel 2.4.1 contains libopenbabel.5.dylib
cheminf
ChemmineOB
Cheminformatics
ChemmineR
2.9 years ago
adelenelai
• 0
0
votes
0
replies
1.4k
views
How to combined multiple *.mol files into a single *.sdf file using ChemmineR?
ChemmineR
Chemmin
ChemmineOB
3.1 years ago
sukissqz
• 0
3
votes
4
replies
1.4k
views
Error in ChemmineR function propOB() and ChemmineOB prop_OB()
ChemmineR
ChemmineOB
updated 3.4 years ago by
Thomas Girke
★ 1.7k • written 3.6 years ago by
teresadijor
• 0
2
votes
6
replies
1.2k
views
How to remove HCL mols in Chemminer
ChemmineR
Chemistry
updated 5.3 years ago by
khoran
▴ 10 • written 5.4 years ago by
Anthony Nash
▴ 20
1
vote
1
reply
959
views
Bioactivity assay DBs for cheminfo packages
bioassayR
ChemmineR
PubChem
updated 5.3 years ago by
Thomas Girke
★ 1.7k • written 5.3 years ago by
Anthony Nash
▴ 20
1
vote
1
reply
935
views
Where can I locate the bioassayR database?
bioassayr
chemmineR
cheminformatics
5.3 years ago
Anthony Nash
▴ 20
1
vote
4
replies
2.2k
views
How do I convert kegg info on drug to a format allowing me to calculate similarities?
keggrest
chemminer
fmcsr
graph
written 6.3 years ago by
Joris.Meys
• 0
0
votes
0
replies
873
views
Downloading 3D compounds from Pubchem in ChemmineR
chemminer
6.7 years ago
jubilantsundar
• 0
1
vote
2
replies
1.5k
views
drawing chemical from smile 2D/3D
chemminer
updated 7.0 years ago by
Thomas Girke
★ 1.7k • written 7.0 years ago by
Stane
▴ 40
0
votes
0
replies
997
views
Tversky' alpha and beta should not be int, should they?
ChemmineR
7.3 years ago
stephan.struckmann
• 0
0
votes
2
replies
1.5k
views
output of propOB function ChemmineR
ChemmineR
ChemmineOB
ChemmineTools
Drug
7.4 years ago
elisa.micarelli
▴ 10
0
votes
1
reply
2.1k
views
ChemmineR package - fpSim and cmp.similarity - Tanimoto kernels
ChemmineR
updated 8.2 years ago by
Thomas Girke
★ 1.7k • written 8.2 years ago by
ረ
• 0
0
votes
0
replies
1.2k
views
MCS & ChemineR
Network
Clustering
PROcess
ChemmineR
Network
Clustering
PROcess
ChemmineR
11.3 years ago
Thomas Girke
★ 1.7k
0
votes
0
replies
1.2k
views
ChemmineR Help
Clustering
ChemmineR
Clustering
ChemmineR
11.6 years ago
Thomas Girke
★ 1.7k
15 results • Page
1 of 1
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Replies
Comment: limma comparison for small sample size and how to get covariance matrix
by
Gordon Smyth
51k
Your MDS plot is better than before, but you are still not following the recommendation for making for making such plots given in the limma…
Comment: Mapping Between GenBank ID's and Uniprot
by
James W. MacDonald
66k
Also, ``` > result <- mapUniProt( from = "EMBL-GenBank-DDBJ_CDS", to = "UniProtKB", query = c("ACF95883.1") ) > result From…
Comment: Mapping Between GenBank ID's and Uniprot
by
James W. MacDonald
66k
Ugh, here's the link https://www.uniprot.org/id-mapping/uniprotkb/dd08aa16774d98ef087dc3bd708582012bba49e2/overview?fields=accession%2Cre…
Answer: Mapping Between GenBank ID's and Uniprot
by
James W. MacDonald
66k
The input should be 'EMBL-GenBank-DDBJ_CDS", as that is a GenBank ID.
Answer: XCMS2 of orbitrap data
by
Elodie
• 0
Hi, I have the same question, I have acquired MS2 data with PRM analysis and inclusion lists of several ions. I have a list of product ion…
Votes
Answer: EPIC array hg38 annotation?
Answer: Why does DESeq2 give negative log2 fold change in treatment vs control for some
Comment: Error while installing BiocManager::install("org.Vdahliae.eg.db")
Comment: Ranking the GSEA Results
Error in `$<-.data.frame`(`*tmp*`, "dispersion", value = NA)
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