PyOpenCL

Open Source in Drug Discovery

Nathan Knapp

July 2023

This presentation gives a brief overview of open source Python software in drug discovery and how Op...

The sxs package

Boyle, Michael
Scheel, Mark

October 2021

A collection of python code used by the SXS collaborationIf you use this software, please cite it as...

pyobo/pyobo v0.3.0

Charles Tapley Hoyt
Benjamin M. Gyori
Daniel Domingo-Fernández

December 2020

A Python package for using ontologies, terminologies, and biomedical nomenclature

PyOpenCL

Kloeckner, Andreas
Yu, Yichao
Wala, Matt
Fernando, Isuru
Bencun, Marko
Kulkarni, Kaushik
Diener, Matthias
Gao, Hao
Fikl, Alex
Weiner, Zach
Weigert, Martin
Palmer, Rebecca
Latham, Shane
Magno, Gonçalo
Fuller, Henry
Mackenzie, Jonathan
Niarchos, Sotiris
Gill, Shahzaib
Gohlke, Christoph
Bhosale, Aditya
Rothberg, Alex
Ey, Emanuel
Rapp, Holger
van der Walt, Stefan
Thalhammer, Gregor
Kieffer, Jerome
Poliarnyi, Nikolai
Bollinger, Drew
Nitz, Alex
Bokota, Grzegorz

March 2022

OpenCL integration for Python, plus shiny featuresIf you use this software, please cite it as below

PyCUDA

Kloeckner, Andreas
Wohlgemuth, Gert
Lee, Gregory
Rybak, Tomasz
Nitz, Alex
Chiang, David
Seibert, Stan
Bergtholdt, Martin
Unterthiner, Thomas
Markall, Graham
Kotak, Mit
Favre-Nicolin, Vincent
Opanchuk, Bogdan
Merry, Bruce
Pinto, Nicolas
Milo, Fabrizio
Collignon, Thomas
Rathgeber, Florian
Perkins, Simon
Rutsky, Vladimir
Catanzaro, Bryan
Park, Alex
Witherden, Freddie
E. Givon, Lev
Pfister, Luke
Brubaker, Marcus
ZA, RA
Hausammann, Loic
Gohlke, Christoph

June 2022

CUDA integration for Python, plus shiny featuresIf you use this software, please cite it as below

pyOpenSci: Open and reproducible research, powered by Python

Trizna, Michael
Wasser, Leah
Nicholson, David

September 2021

pyOpenSci (short for Python Open Science), funded by the Alfred P. Sloan Foundation, is building a d...

An Introduction to Python for Chemists

McCluskey, Andrew R.
Dean, Jacob M.
Squires, Alexander G.
Meli, Rocco
Glass, William G.
Symington, Adam R.
Morgan, Benjamin J.

August 2020

An open-source project to develop an introductory textbook covering all aspects of Python programmin...

pyOpenSci: A diverse community that supports open tools that drive open science

Leah Wasser

October 2022

pyOpenSci builds a diverse community around the free and open Python tools that drive open science t...

Pypolyline

Hügel, Stephan

December 2021

Pypolyline: a Python library for Google Polyline encoding and decodingIf you use this software, plea...

Open Source in Drug Discovery

Nathan Knapp

July 2023

This presentation gives a brief overview of open source Python software in drug discovery and how Op...

The sxs package

Boyle, Michael
Scheel, Mark

October 2021

A collection of python code used by the SXS collaborationIf you use this software, please cite it as...

pyobo/pyobo v0.3.0

Charles Tapley Hoyt
Benjamin M. Gyori
Daniel Domingo-Fernández

December 2020

A Python package for using ontologies, terminologies, and biomedical nomenclature

PyOpenCL

Kloeckner, Andreas
Yu, Yichao
Wala, Matt
Fernando, Isuru
Bencun, Marko
Kulkarni, Kaushik
Diener, Matthias
Gao, Hao
Fikl, Alex
Weiner, Zach
Weigert, Martin
Palmer, Rebecca
Latham, Shane
Magno, Gonçalo
Fuller, Henry
Mackenzie, Jonathan
Niarchos, Sotiris
Gill, Shahzaib
Gohlke, Christoph
Bhosale, Aditya
Rothberg, Alex
Ey, Emanuel
Rapp, Holger
van der Walt, Stefan
Thalhammer, Gregor
Kieffer, Jerome
Poliarnyi, Nikolai
Bollinger, Drew
Nitz, Alex
Bokota, Grzegorz

March 2022

OpenCL integration for Python, plus shiny featuresIf you use this software, please cite it as below

PyCUDA

Kloeckner, Andreas
Wohlgemuth, Gert
Lee, Gregory
Rybak, Tomasz
Nitz, Alex
Chiang, David
Seibert, Stan
Bergtholdt, Martin
Unterthiner, Thomas
Markall, Graham
Kotak, Mit
Favre-Nicolin, Vincent
Opanchuk, Bogdan
Merry, Bruce
Pinto, Nicolas
Milo, Fabrizio
Collignon, Thomas
Rathgeber, Florian
Perkins, Simon
Rutsky, Vladimir
Catanzaro, Bryan
Park, Alex
Witherden, Freddie
E. Givon, Lev
Pfister, Luke
Brubaker, Marcus
ZA, RA
Hausammann, Loic
Gohlke, Christoph

June 2022

CUDA integration for Python, plus shiny featuresIf you use this software, please cite it as below

pyOpenSci: Open and reproducible research, powered by Python

Trizna, Michael
Wasser, Leah
Nicholson, David

September 2021

pyOpenSci (short for Python Open Science), funded by the Alfred P. Sloan Foundation, is building a d...

An Introduction to Python for Chemists

McCluskey, Andrew R.
Dean, Jacob M.
Squires, Alexander G.
Meli, Rocco
Glass, William G.
Symington, Adam R.
Morgan, Benjamin J.

August 2020

An open-source project to develop an introductory textbook covering all aspects of Python programmin...

pyOpenSci: A diverse community that supports open tools that drive open science

Leah Wasser

October 2022

pyOpenSci builds a diverse community around the free and open Python tools that drive open science t...

Pypolyline

Hügel, Stephan

December 2021

Pypolyline: a Python library for Google Polyline encoding and decodingIf you use this software, plea...

Open Source in Drug Discovery

Nathan Knapp

July 2023

This presentation gives a brief overview of open source Python software in drug discovery and how Op...

The sxs package

Boyle, Michael
Scheel, Mark

October 2021

A collection of python code used by the SXS collaborationIf you use this software, please cite it as...

pyobo/pyobo v0.3.0

Charles Tapley Hoyt
Benjamin M. Gyori
Daniel Domingo-Fernández

December 2020

A Python package for using ontologies, terminologies, and biomedical nomenclature

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PyOpenCL

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