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Landrum, Greg
152
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Online (152)
Mediatypes
Articles (Online) (14)
OpenAccess-fulltext (138)
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1
An open source chemical structure curation pipeline using R..:
Bento, A. Patrícia
;
Hersey, Anne
;
Félix, Eloy
...
Journal of Cheminformatics. 12 (2020) 1 - p. , 2020
Link:
https://doi.org/10.1186/..
?
2
The integration of Open3DTOOLS into the RDKit and KNIME:
Tosco, Paolo
;
Stiefl, Nikolaus
;
Landrum, Greg
Journal of Cheminformatics. 6 (2014) S1 - p. , 2014
Link:
https://doi.org/10.1186/..
?
3
What is InChI? A user's perspective on identifiers and repr..:
Landrum, Greg
doi:10.5281/zenodo.7435206. , 2022
Link:
https://zenodo.org/recor..
?
4
An open source chemical structure curation pipeline using R..:
Bento, A. Patrícia
;
Hersey, Anne
;
Félix, Eloy
...
doi:10.17863/CAM.56899. , 2020
Link:
https://doi.org/10.17863..
?
5
An open source chemical structure curation pipeline using R..:
Bento, A. Patrícia
;
Hersey, Anne
;
Félix, Eloy
...
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7458899/. , 2020
Link:
http://www.ncbi.nlm.nih...
?
6
The integration of Open3DTOOLS into the RDKit and KNIME:
Tosco, Paolo
;
Stiefl, Nikolaus
;
Landrum, Greg
http://www.jcheminf.com/content/6/S1/P8. , 2014
Link:
http://www.jcheminf.com/..
?
7
chembl/FPSim2: 0.4.3:
Eloy Félix
;
Andrew Dalke
;
Greg Landrum
https://github.com/chembl/FPSim2/tree/0.4.3. , 2023
Link:
https://zenodo.org/recor..
?
8
volkamerlab/teachopencadd: 2023.05.2:
Dominique Sydow
;
jaimergp
;
Talia B. Kimber
...
https://github.com/volkamerlab/teachopencadd/tree/2023.05.2. , 2023
Link:
https://zenodo.org/recor..
?
9
rdkit/rdkit: 2022_09_5 (Q3 2022) Release:
Greg Landrum
;
Paolo Tosco
;
Brian Kelley
...
https://github.com/rdkit/rdkit/tree/Release_2022_09_5. , 2023
Link:
https://zenodo.org/recor..
?
10
rdkit/rdkit: 2023_03_1b1 (Q1 2023) Release:
Greg Landrum
;
Paolo Tosco
;
Brian Kelley
...
https://github.com/rdkit/rdkit/tree/Release_2023_03_1b1. , 2023
Link:
https://zenodo.org/recor..
?
11
rdkit/rdkit: 2023_03_3 (Q1 2023) Release:
Greg Landrum
;
Paolo Tosco
;
Brian Kelley
...
https://github.com/rdkit/rdkit/tree/Release_2023_03_3. , 2023
Link:
https://zenodo.org/recor..
?
12
chembl/FPSim2: 0.4.5:
Eloy Félix
;
Andrew Dalke
;
Greg Landrum
https://github.com/chembl/FPSim2/tree/0.4.5. , 2023
Link:
https://zenodo.org/recor..
?
13
rdkit/rdkit: 2022_09_4 (Q3 2022) Release:
Greg Landrum
;
Paolo Tosco
;
Brian Kelley
...
https://github.com/rdkit/rdkit/tree/Release_2022_09_4. , 2023
Link:
https://zenodo.org/recor..
?
14
rdkit/rdkit: 2023_03_2 (Q1 2023) Release:
Greg Landrum
;
Paolo Tosco
;
Brian Kelley
...
https://github.com/rdkit/rdkit/tree/Release_2023_03_2. , 2023
Link:
https://zenodo.org/recor..
?
15
rdkit/rdkit: 2023_03_1 (Q1 2023) Release:
Greg Landrum
;
Paolo Tosco
;
Brian Kelley
...
https://github.com/rdkit/rdkit/tree/Release_2023_03_1. , 2023
Link:
https://zenodo.org/recor..
1-15
