NBHub | ABACUS+DeePKS Step-by-Step Practical Tutorial: Using the Perovskite System as an Example

Nice! 75 posts in total. Keep on posting.

202437

10-17

NBHub | ABACUS+DeePKS Step-by-Step Practical Tutorial: Using the Perovskite System as an Example

10-16

What Can Uni-Mol Do too? | Multi-objective optimization unlocks a new evolutionary approach to chemical product design

09-01

ReacNetGenerator | Partnering with the DeepModeling Community to Advance Research on Complex Reaction Systems

08-23

DeepFlame 1.4 Released, Introducing Full-Speed Range Multiphase Reactive Flow Solver

08-21

What Can Uni-Mol Do too? | Breaking the Limits of Few-shot Molecular Property Prediction

08-15

DeePTB | It supports strictly localized equivariant representation LCAO-quantum operators

08-08

What Can Uni-Mol Do too? | Unveiling NAG2G: A Powerful Tool for Enhancing Single-Step Retrosynthesis Prediction

07-29

2024 Q2 OpenLAM Report｜More Stable Code, Richer Domain Models

07-22

What Can Uni-Mol Do too? | Unveiling DeepGlycanSite: Precise Prediction of Carbohydrate Binding Sites

07-05

Uni-Mol: Partnering with the DeepModeling Community to Build a Foundational Model for Molecular Design