Protocols

MolProp TK specifications

Information


Unique identifier OMICS_33650
Name MolProp TK
Software type Toolkit/Suite
Interface Graphical user interface
Restrictions to use License purchase required
Operating system Unix/Linux, Mac OS, Windows
Programming languages Python
Computer skills Medium
Version 2.5.1
Stability Stable
Registration required Yes
Maintained Yes

Versioning


No version available

Additional information


https://docs.eyesopen.com/toolkits/python/molproptk/index.html

MolProp TK citation

call_split

Strategy To Discover Diverse Optimal Molecules in the Small Molecule Universe

2015
J Chem Inf Model
PMCID: 4372820
PMID: 25594586
DOI: 10.1021/ci500749q
call_split See protocol

[…] Property-optimizing ACSESS made use of OpenEye OEChem TK for molecule generation, OpenEye MolProp TK for filtering, and OpenEye OMEGA TK, for conformer generation. […]

MolProp TK institution(s)
OpenEye Scientific, Santa Fe, NM, USA

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