Special Interest Groups


Topic Replies Created
Identify Salts in molecules 2 June 18, 2018
connect a compounds list to an online tool 3 May 4, 2018
SMILEs in Excel 4 February 18, 2015
string to fingerprint 3 April 17, 2018
SAS XPORT file reader / SEND file reader now available in Lhasa community contribution 4 December 5, 2017
Canvas Fingerprint Generation Execute failed 2 March 22, 2018
Vernalis Matched Molecular pairs updates 6 February 17, 2016
3D-e-Chem nodes 5 February 21, 2018
PaDEL Issue 4 July 20, 2017
OpenBabel node - is there one or not? 2 January 18, 2018
Questions about MarvinSketch & MolConverter Nodes 5 December 12, 2017
Comparing molecules by Tversky similarity 4 March 10, 2017
Missing molecule to indigo 4 April 27, 2017
Error with OpenBabel on Mac 3 June 20, 2017
Chemical library overlap 4 November 10, 2017
CheEMBLdb Connector Input fails 4 February 26, 2017
RDKit Fingerprint node MACCs keys gives wrong number of bits 2 October 17, 2017
SyGMA python package install 3 July 11, 2017
creating compound library in KNIME 3 August 3, 2017
convert into high predictive throughput workflow 3 July 26, 2017
Lhasa Limited's trusted contribution now on Bitbucket 1 August 10, 2017
Cross validation Q2 2 July 31, 2017
Chemical Identifier Resolver issues with Knime 3.3 5 December 15, 2016
Subtracting the MCS to the Original Molecule 2 July 20, 2017
INDIGO installation does not work on KNIME 3.4.4 3 July 19, 2017
Vernalis Matched Molecular Pairs (MMP) Nodes updated 1 July 7, 2017
Changes to RCSB PDB queries 1 June 21, 2017
Identifying Molecular and Electronic Rearrangements 3 May 4, 2017
Input data format for Model Acceptability Criteria node 3 February 12, 2017
Clarification on the functioning of the Model Acceptability Criteria node 4 January 13, 2016