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Anoop Lab (anooplab)

anooplab

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Company:Dr. Anoop Ayyappan, Department of Chemistry, Indian Institute of Technology Kharagpur

Location:Kharagpur, West Bangal, India

Home Page:anooplab.in

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Anoop Lab's repositories

pyar

Python program for aggregation and reaction

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distances

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eSIgen4qc

eSIgen4qc is a tool that generates electronic supporting information (ESI) for quantum chemistry, focusing on ORCA output files. It extracts properties like energy, free energy, zero-point energy (ZPE), and NImag and presents them in an organized table for convenient reading.

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ssa

Our implementation of Gillespie's Stochastic Simulation Algorithm (SSA)

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anooplab

Config files for my GitHub profile.

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anooplab.github.io

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homepage-source

The institute webstie

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pyar-bh

Basinhopping

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pyar-de

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