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author | Johannes Ranke <jranke@uni-bremen.de> | 2015-10-16 15:35:33 +0200 |
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committer | Johannes Ranke <jranke@uni-bremen.de> | 2015-10-16 15:35:33 +0200 |
commit | 26748e386a386f8459edb4f061012f099d34de7d (patch) | |
tree | 554f7fb173a8e86b49c8be8711d68ea3fbad4d30 /man | |
parent | a892d1dc3c2a3724063f4d671f7f261ff5392884 (diff) |
Some improvements, especially in loading chyaml
Diffstat (limited to 'man')
-rw-r--r-- | man/chent.Rd | 8 | ||||
-rw-r--r-- | man/plot.chent.Rd | 3 |
2 files changed, 6 insertions, 5 deletions
diff --git a/man/chent.Rd b/man/chent.Rd index da68b56..00516b9 100644 --- a/man/chent.Rd +++ b/man/chent.Rd @@ -29,15 +29,17 @@ python bindings are installed. \item{\code{rdkit}}{List of information obtained with RDKit} \item{\code{Picture}}{Graph as a \code{\link{picture}} object obtained using grImport} + +\item{\code{chyaml}}{List of information obtained from a YAML file} + +\item{\code{degradation}}{List of degradation endpoints} }} \examples{ oct <- chent$new("1-octanol", smiles = "CCCCCCCCO") -oct$try_pubchem() print(oct) plot(oct) -caffeine <- chent$new("caffeine", source = "pubchem") +caffeine <- chent$new("caffeine") print(caffeine) -caffeine$get_rdkit() plot(caffeine) } \keyword{data} diff --git a/man/plot.chent.Rd b/man/plot.chent.Rd index f2e7572..3fd2ac6 100644 --- a/man/plot.chent.Rd +++ b/man/plot.chent.Rd @@ -15,9 +15,8 @@ Plot method for chent objects } \examples{ -caffeine <- chent$new("caffeine", source = "pubchem") +caffeine <- chent$new("caffeine") print(caffeine) -caffeine$get_rdkit() plot(caffeine) } |