Ajaykhanna
Ph.D. Candidate in Computational Chemistry @UCMerced.
University of California MercedMerced, California
Ajaykhanna's Stars
EbookFoundation/free-programming-books
:books: Freely available programming books
jwasham/coding-interview-university
A complete computer science study plan to become a software engineer.
codecrafters-io/build-your-own-x
Master programming by recreating your favorite technologies from scratch.
kamranahmedse/developer-roadmap
Interactive roadmaps, guides and other educational content to help developers grow in their careers.
f/awesome-chatgpt-prompts
This repo includes ChatGPT prompt curation to use ChatGPT better.
karpathy/LLM101n
LLM101n: Let's build a Storyteller
Ebazhanov/linkedin-skill-assessments-quizzes
Full reference of LinkedIn answers 2024 for skill assessments (aws-lambda, rest-api, javascript, react, git, html, jquery, mongodb, java, Go, python, machine-learning, power-point) linkedin excel test lösungen, linkedin machine learning test LinkedIn test questions and answers
eugeneyan/open-llms
📋 A list of open LLMs available for commercial use.
cupy/cupy
NumPy & SciPy for GPU
aishwaryanr/awesome-generative-ai-guide
A one stop repository for generative AI research updates, interview resources, notebooks and much more!
udlbook/udlbook
Understanding Deep Learning - Simon J.D. Prince
verazuo/jailbreak_llms
[CCS'24] A dataset consists of 15,140 ChatGPT prompts from Reddit, Discord, websites, and open-source datasets (including 1,405 jailbreak prompts).
Peldom/papers_for_protein_design_using_DL
List of papers about Proteins Design using Deep Learning
AspirinCode/papers-for-molecular-design-using-DL
List of Molecular and Material design using Generative AI and Deep Learning
ehoogeboom/e3_diffusion_for_molecules
deepfindr/gnn-project
A Graph Neural Network project on HIV data
molmod/openmm-tutorial-msbs
OpenMM tutorial for the MSBS course
openforcefield/openff-forcefields
Force fields produced by the Open Force Field Initiative
kthpanor/echem
eChem: Jupyter book on theoretical chemistry
Isra3l/ligpargen
michellab/a3fe
Automated Adaptive Absolute alchemical Free Energy calculator
keiradams/SQUID
Official implementation of "Equivariant Shape-Conditioned Generation of 3D Molecules for Ligand-Based Drug Design"
BaratiLab/GAMD
Data and code for graph neural network accelerated molecular dynamics
cdsgroup/resp
A. Alenaizan's restricted electrostatic potential (RESP) plugin to Psi4
Arif-PhyChem/datasets_and_databases_4_MLPs
RagnarB83/chemshell-QMMM-protein-setup
MM and QM/MM setup for a metalloprotein using GROMACS, Chemshell and ORCA (Using the CHARMM forcefield (both in GROMACS and with Chemshell) and the ORCA code as QM code for Chemshell.)
mdommett/exciton_coupling
Various methods to calculate the excitonic coupling in molecular pairs
peverati/Devil_DFT_Tutorial_IJQC_2020
The Devil in the Details: A Tutorial Review on Some Undervalued Aspects of Density Functional Theory Calculations
olcf/HIP_for_CUDA_programmers
ph7klw76/terachem
A series of program developed to interface with Terachem at UM DICC to automate the calculations