ltimmerman3 Goto Github PK

deeplearningpython

neuralnetworksanddeeplearning.com integrated scripts for Python 3.5.2 and Theano with CUDA support

dflowr_notebooks

code for deep learning courses

equiformer_v2

[ICLR'24] EquiformerV2: Improved Equivariant Transformer for Scaling to Higher-Degree Representations

gen_ml

Repo to play around with ML on my laptop

gmp_python

Home for python implementation of GMP MCSH descriptors to be used for prototyping and testing.

hartreefock

Test repository that I may use for the Hartree Fock project in Comp Chem

mcsh_c_implementation

C implementation of the MCSH descriptors

medford

ml-catalysis

Repo for assignments/training for the ML for Catalysis VIP subteam

numerical_methods

Learning space for new numerical methods

ocp

Open Catalyst Project's library of machine learning methods for catalysis

procsys_project

Shared repo for Process Systems Engineering Project - ChBE 6746/4746

singelnn_gmp_paper

Code for generating and analyzing data for SingelNN_GMP paper. Will include figures as well

sparc-dft-api

workshop_sparc

Materials for the SPARC tutorial at ACS CATL Fall 2022 Open Source Software Workshops