Pinned Repositories
aimnet
Atoms In Molecules Neural Network Potential
alanates_dev
ASE_ANI
ANI-1 neural net potential with python interface (ASE)
calculate_SA_PV_H2_UP
compPhyMC
ConfGen
data_text_minig
deepMOF
deepMOF
deepQM
mdutils
otayfuroglu's Repositories
otayfuroglu/deepQM
otayfuroglu/deepMOF
deepMOF
otayfuroglu/mdutils
otayfuroglu/aimnet
Atoms In Molecules Neural Network Potential
otayfuroglu/alanates_dev
otayfuroglu/ASE_ANI
ANI-1 neural net potential with python interface (ASE)
otayfuroglu/calculate_SA_PV_H2_UP
otayfuroglu/compPhyMC
otayfuroglu/ConfGen
otayfuroglu/data_text_minig
otayfuroglu/deepMOF_dev
Development NNP for MOFs
otayfuroglu/lammps_interface
automatic generation of LAMMPS input files for molecular dynamics simulations of MOFs
otayfuroglu/openmmMLMD
scripts for openmm using ML potentials
otayfuroglu/schnetpack
SchNetPack - Deep Neural Networks for Atomistic Systems
otayfuroglu/deepPotential
otayfuroglu/Neural-Network-Models-for-Chemistry
A collection of Nerual Network Models for chemistry
otayfuroglu/osmotic_mcmd
otayfuroglu/qe_interface