Automatic Differentiation Multipole Moment Molecular Forcefield
On a single gpu, using waterbox_31ang.pdb example from MPIDplugin which contains 2988 atoms, reciprocal space energy and force calculation (by value_and_grad) takes
105 ms ± 359 µs per loop (mean ± std. dev. of 7 runs, 10 loops each)
self energy is expectedly negligible.
142 µs ± 3.93 µs per loop (mean ± std. dev. of 7 runs, 10000 loops each)
AugMax: Adversarial Composition of Random Augmentations for Robust Training Haotao Wang, Chaowei Xiao, Jean Kossaifi, Zhiding Yu, Anima Anandkumar, an
FairFuzz An AFL extension to increase code coverage by targeting rare branches. FairFuzz has a particular advantage on programs with highly nested str
Brainstorm Discontinuation Notice Brainstorm is no longer being maintained, so we recommend using one of the many other,available frameworks, such as
UNION Automatic Evaluation Metric described in the paper UNION: An UNreferenced MetrIc for Evaluating Open-eNded Story Generation (EMNLP 2020). Please
Neighborhood Reconstructing Autoencoders The official repository for Neighborhood Reconstructing Autoencoders (Lee, Kwon, and Park, NeurIPS 2021). T
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Struct-MDC (click the above buttons for redirection!) Official page of "Struct-MDC: Mesh-Refined Unsupervised Depth Completion Leveraging Structural R
Experimenting with computer vision techniques to generate annotated image datasets from gameplay recordings automatically. The collected data will then be used to train a deep neural network that can
FGVC8 Exploring Vision Transformers for Fine-grained Classification paper presented at the CVPR 2021, The Eight Workshop on Fine-Grained Visual Catego
CAUSE: Causality from AttribUtions on Sequence of Events
Introduction This repo contains code for reproducing the results in the paper Graphical Models with Attention for Context-Specific Independence and an
OOD-on-NAE Research project on out of distribution detection for the Computer Vision course by Prof. Rob Fergus (CSCI-GA 2271) Paper out on arXiv - ht
Scaling The Scattering Transform : Deep Hybrid Networks This repository contains the experiments found in the paper: https://arxiv.org/abs/1703.08961
DIFFNet This repo is for Self-Supervised Monocular DepthEstimation with Internal Feature Fusion(arXiv), BMVC2021 A new backbone for self-supervised de
DFL-Colab — DeepFaceLab fork for Google Colab This project provides you IPython Notebook to use DeepFaceLab with Google Colaboratory. You can create y
Installation Setup with Conda # create a new environment conda create --name insightKface python=3.7 # or over conda activate insightKface #install t
A collection of scripts I developed for personal and working projects Table of contents Introduction Repository diagram structure List of scripts pyth
MarkovGNN This is the official PyTorch-Geometric implementation of MarkovGNN paper under the title "MarkovGNN: Graph Neural Networks on Markov Diffusi
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