atiffaiz1

Scientist at @schrodinger. Computational Chemistry and Machine Learning.

Pinned Repositories

CSC-UB
This repository contains all the files of workshops and seminars that were organized as part of the Computational Sciences Club at University at Buffalo
Language:TeX00
My_CV
Language:HTML00
chemhtps
ChemHTPS is an automated high-throughput screening platform for generating materials and chemical data
Language:Python61
chemlg
ChemLG is a smart and massive parallel molecular library generator for chemical and materials sciences.
Language:Python196
Coursework_Git
This repository contains files of some selected course work that I have done during my PhD studies.
Language:MATLAB00
PhD-Dissertation
LaTeX files of my PhD Dissertation
Language:PostScript00
tensorflow
Computation using data flow graphs for scalable machine learning
Language:C++00
Slonimskii_method_vdW
This script gives the van der Waals volume for the molecules based on the Slonimskii method.
Language:Python20

atiffaiz1/PhD-Dissertation
LaTeX files of my PhD Dissertation
Language:PostScript
atiffaiz1/CSC-UB
This repository contains all the files of workshops and seminars that were organized as part of the Computational Sciences Club at University at Buffalo
Language:TeX
atiffaiz1/tensorflow
Computation using data flow graphs for scalable machine learning
Language:C++
atiffaiz1/My_CV
Language:HTML
atiffaiz1/Coursework_Git
This repository contains files of some selected course work that I have done during my PhD studies.
Language:Matlab