Parent Categories/Forums: The Chemistry Development Kit
Edit this Forum

cdk-user

Search:
This forum is an archive for the mailing list: cdk-user@lists.sourceforge.net (mailing list options). Messages posted here will be sent to this mailing list.

Mailing list archive for cdk-user
Child Forums (0): None
To migrate this forum to the new Nabble2 system, please post a request in the Nabble Support forum — Learn more
Post to cdk-user Post New Message  ::  Alert me of new posts  ::  Rating Filter:
« Newest  ‹ Newer  —  Threads 1-35  —  Older

Thread (515 Threads) Rating Replies Last Message

New chemical software by remy d1
1
by Geoffrey Hutchison-5

Re: Cdk-user Digest, Vol 42, Issue 13 by Aziz Yasri-2
0
by Aziz Yasri-2

Strange SMILES produced by CDK by Dmitry Pavlov-4
11
by Dmitry Pavlov-4

Re: Cdk-user Digest, Vol 42, Issue 10 by Aziz Yasri-2
2
by Mark Rijnbeek

30 min for PEOE Partial Charge calculation by Gwenael Chevé
0
by Gwenael Chevé

SMARTS question by Mark Rijnbeek
9
by Rajarshi Guha-4

Re: SMARTS question (Rajarshi Guha) by Loren Lenzen
1
by Rajarshi Guha-4

Hydrogen atomic number is null by Vincent Le Guilloux
1
by Egon Willighagen-5

Re: Cdk-user Digest, Vol 42, Issue 4 by Aziz Yasri-2
0
by Aziz Yasri-2

Wrong atom types assignements by Aziz Yasri-2
1
by Egon Willighagen-5

Aromatization & SDF bond type by Vincent Le Guilloux
7
by Rajarshi Guha-4

making a chemical database by ramakaalia
3
by Stefan Kuhn-3

installation by stanley5101
1
by Rajarshi Guha-4

Re: Fwd: [InChI-discuss] Aromatic molecules by Vincent Le Guilloux
0
by Vincent Le Guilloux

CML question by Mark Rijnbeek
2
by Angel Herráez

SMARTS & SMILES by remy d1
4
by Egon Willighagen-5

Google Wave Invite: but you need to work on the CDK and the CDKitty robot by Egon Willighagen-5
0
by Egon Willighagen-5

Fwd: [InChI-discuss] Aromatic molecules by Egon Willighagen-5
0
by Egon Willighagen-5

[JCP applet]Smiles and aromaticity by remy d1
2
by Egon Willighagen-5

MCS indices mapping by Tiqing Liu
0
by Tiqing Liu

Build CDK in NetBeans by Andrzej Okuniewski
1
by Vincent Le Guilloux

New release of Cinfony with CDK 1.2.3 by baoilleach
0
by baoilleach

Get image from JCP applet by remy d1
10
by remy d1

Fwd: Re: Get image from JCP applet by Stefan Kuhn-3
0
by Stefan Kuhn-3

you've got wild ideas? enter them on this forum by Egon Willighagen-5
0
by Egon Willighagen-5

regarding smarts searching performance by sapana
1
by Rajarshi Guha-4

problem related to smarts searching performance?? by suyog
1
by Rajarshi Guha-4

JCP applet editor options by remy d1
9
by remy d1

CDK 20060714 released by Egon Willighagen-4
1
by suyog

Question about Renderer2DModel.setBackColor and Renderer2DModel fonts by Scooter Morris-2
1
by Egon Willighagen-5

calculating all possible bond distances between the two Functional Groups??? by suyog
2
by suyog

JOElib converter by Vincent Le Guilloux
22
by Egon Willighagen-5

SMARTSParser.jjt error by Syed Asad Rahman-2
4
by Syed Asad Rahman-2

Re: CDK bonds rendering by Egon Willighagen-5
0
by Egon Willighagen-5

Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart by Tobias Girschick-2
7
by Rajarshi Guha-4
Post to cdk-user Post New Message  ::  Alert me of new posts  ::  Atom feed for cdk-user
« Newest  ‹ Newer  —  Threads 1-35  —  Older