Search results

bug: BondTypeCountFeaturizer

Status: Open.

#125 In lamalab-org/chem-caption;

· AdrianM0 opened on Aug 1, 2025

Gordan's list

priority

Status: Open.

Task

#122 In lamalab-org/chem-caption;

· Stoick01 opened on Jun 30, 2025

add reference for lead-likeness filter

Status: Open.

#119 In lamalab-org/chem-caption;

· kjappelbaum opened on Feb 11, 2024

Inconsistent preset API

Status: Open.

#118 In lamalab-org/chem-caption;

· kjappelbaum opened on Feb 11, 2024

cache expensive calls

enhancementNew feature or requestNew feature or request

Status: Open.

#109 In lamalab-org/chem-caption;

· kjappelbaum opened on Jan 11, 2024

replace prints with logger calls

enhancementNew feature or requestNew feature or request

Status: Open.

#106 In lamalab-org/chem-caption;

· kjappelbaum opened on Jan 11, 2024

zerodivision error in bondtypefeaturizer

priority

Status: Open.

#105 In lamalab-org/chem-caption;

· kjappelbaum opened on Dec 1, 2023

check if the conformers we get make sense

priority

Status: Open.

#97 In lamalab-org/chem-caption;

· kjappelbaum opened on Oct 30, 2023

Bugs spotted when going through export

bugSomething isn't workingSomething isn't working

priority

Status: Open.

#95 In lamalab-org/chem-caption;

· kjappelbaum opened on Oct 24, 2023

set up README and Docs to give clear credit to Benedict

priority

Status: Open.

#92 In lamalab-org/chem-caption;

· kjappelbaum opened on Oct 15, 2023

from featurizers, export information for <code>meta.yaml</code>

priority

Status: Open.

#89 In lamalab-org/chem-caption;

· kjappelbaum opened on Oct 13, 2023

prepare JOSS manuscript

Status: Open.

#88 In lamalab-org/chem-caption;

· kjappelbaum opened on Oct 13, 2023

· 

Make ready for paper