#

smarts

Here are 7 public repositories matching this topic...

epam / Indigo

Universal cheminformatics toolkit, utilities and database search tools

python java chemistry cheminformatics dotnet postgresql webassembly drug-discovery bingo indigo smiles smarts inchi molfile molecule-visualization

Updated Nov 15, 2024
C++

EYcalc

PerovskitePV / EYcalc

This software calculates the Energy Yield of single and multi-junction solar cells. It consists of individual modules taking care of deriving realistic irradiance data, fast optical and electrical simulations, and derivation of the hourly resolved energy yield.

energy modules simulation matlab solar optics cells yield irradiance smarts photovoltaics tmy3 4t 3t electrics ecostress 2t

Updated Aug 31, 2022
MATLAB

rwst / yaccl

yet another ChemClassifier (Python based on wikibase-cli and rdkit)

cheminformatics classification smiles smarts

Updated Feb 28, 2022
Python

cmelab / grits

A toolkit for working with coarse-grain systems

smiles coarse-grained smarts coarse-graining backmapping coarse-to-fine coarse-grain-mappings

Updated Oct 7, 2024
Python

tmiraglio / SUREHYP

This package was designed to obtain desmiled, destriped and georeferenced reflectance images from Hyperion imagery.

hyperion remote-sensing hyperspectral smarts atmospheric-correction

Updated Dec 13, 2022
Python

trevorgokey / besmarts

A toolkit for data-driven force field design based on binary-encoded SMARTS

cheminformatics smarts forcefields

Updated Sep 10, 2024
Python

iavtamvan / T-SMART

apps smart smarts aplikasi t-smart pintarapps smartt appssmart smartapps tsmart

Updated Feb 19, 2019
Java

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