Alternatives and similar repositories for SpectrumML_Survey_Papers

Users that are interested in SpectrumML_Survey_Papers are comparing it to the libraries listed below

• rxn4chemistry / multimodal-spectroscopic-dataset
  Code for generation and benchmarks of the Multimodal Spectroscopic Dataset
  ☆50Updated 5 months ago
• GenSI-THUAIR / MolCRAFT
  Official repository for MolCRAFT series
  ☆131Updated last month
• AzureLeon1 / MolSpectra
  [ICLR 2025] The source code of "MolSpectra: Pre-training 3D Molecular Representation with Multi-modal Energy Spectra"
  ☆16Updated 7 months ago
• jkwang93 / Token-Mol
  Token-Mol 1.0：tokenized drug design with large language model
  ☆57Updated last month
• KyGao / Mol-StrucTok
  Serializing molecule 3D structures
  ☆14Updated last year
• GenSI-THUAIR / GeoBFN
  Implementation for ICLR2024 Oral paper "Unified Generative Modeling of 3D Molecules with Bayesian Flow Networks"
  ☆59Updated last year
• REAL-Lab-NU / Awesome-LLM-Centric-Molecular-Discovery
  A collection of AWESOME things about LLM-Centric-Molecular-Discovery.
  ☆19Updated 6 months ago
• OpenDFM / LLM4Chemistry
  [COLING 2025]A curated paper list about LLMs for chemistry
  ☆117Updated 2 weeks ago
• lsh0520 / 3D-MoLM
  ☆51Updated last year
• GLAD-RUC / GGNN4Science
  ☆136Updated 5 months ago
• KehanGuo2 / MolPuzzle
  [NeurIPS 24] Can LLMs Solve Molecule Puzzles? A Multimodal Benchmark for Molecular Structure Elucidation
  ☆16Updated 8 months ago
• chao1224 / Geom3D
  Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023
  ☆128Updated last year
• AzureLeon1 / awesome-molecular-diffusion-models
  A curated list of papers related to molecular diffusion models.
  ☆69Updated 5 months ago
• MinkaiXu / AliDiff
  NeurIPS24: Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization
  ☆39Updated 7 months ago
• bowen-gao / DrugCLIP
  [NeurIPS 2023] DrugCLIP: Contrastive Protein-Molecule Representation Learning for Virtual Screening
  ☆118Updated this week
• alxfgh / Large-Language-Models-in-Chemistry
  Working collection of papers, repos and models of transformer based language models trained or tuned for the Chemical domain, from natura…
  ☆68Updated 2 years ago
• bjing2016 / mdgen
  Generative modeling of molecular dynamics trajectories
  ☆178Updated last week
• THUNLP-MT / GET
  This repo contains the codes for our paper "Generalist Equivariant Transformer Towards 3D Molecular Interaction Learning" (ICML 2024).
  ☆39Updated 4 months ago
• coleygroup / ms-pred
  Predicting tandem mass spectra from molecules
  ☆114Updated last month
• c-tl / GeoMFormer
  ☆17Updated last year
• deepmodeling / SciAssess
  SciAssess is a comprehensive benchmark for evaluating Large Language Models' proficiency in scientific literature analysis across various…
  ☆81Updated 6 months ago
• jfjoung / mechanism_prediction
  ☆31Updated last year
• jiaxianyan / BioMiner
  A Multi-modal System for Automated Mining of Protein-Ligand Bioactivity Data from Literature
  ☆61Updated 4 months ago
• Colin-Jay / NMRNet
  ☆48Updated 3 months ago
• zjunlp / MolGen
  [ICLR 2024] Domain-Agnostic Molecular Generation with Chemical Feedback
  ☆181Updated 11 months ago
• QizhiPei / Awesome-Biomolecule-Language-Cross-Modeling
  Awesome-Biomolecule-Language-Cross-Modeling: a curated list of resources for paper "Leveraging Biomolecule and Natural Language through M…
  ☆233Updated this week
• datamol-io / safe
  A single model for all your molecular design tasks
  ☆154Updated 2 months ago
• junxia97 / IFM
  [NeurIPS 2023] "Understanding the Limitations of Deep Models for Molecular Property Prediction: Insights and Solutions"
  ☆11Updated last year
• HelloJocelynLu / t5chem
  Transformer-based model for chemical reactions
  ☆88Updated 7 months ago
• wzxxxx / Prompt-MolOpt
  a multi-property optimization method.
  ☆32Updated 11 months ago