schwallergroup / gollumView external linksLinks
☆36Oct 10, 2025Updated 4 months ago
Alternatives and similar repositories for gollum
Users that are interested in gollum are comparing it to the libraries listed below
Sorting:
- RunAI&KG prize winner of the 2024 LLM hackathon in materials and chemistry. Create a glossary out of your manuscript in materials and che…☆12Aug 15, 2025Updated 6 months ago
- This is an updated version of the MolecularTransformer of Schwaller et. al.☆14Jan 17, 2022Updated 4 years ago
- AROPS: A Framework of Automated Reaction Optimization with Parallelized Scheduling☆11Feb 28, 2023Updated 2 years ago
- ☆31Nov 15, 2022Updated 3 years ago
- ☆19Dec 17, 2025Updated last month
- Research Paper: "Graph Contrastive Learning as a Versatile Foundation for Advanced scRNA-seq Data Analysis"☆10Nov 20, 2024Updated last year
- Bayesian optimization with Standard Gaussian Processes on high dimensional benchmarks☆19Jun 29, 2025Updated 7 months ago
- ☆21Jul 25, 2024Updated last year
- ☆24Nov 24, 2024Updated last year
- Extract structure-functions from data using XAI and LLMs☆27Jan 20, 2025Updated last year
- Chemistry-related Python utilities used in the RXN universe☆25Jul 18, 2024Updated last year
- Bayesian MPNNs for Molecular Property Prediction☆30Dec 30, 2020Updated 5 years ago
- a curated list of resources for everyone interested in learning about digital chemistry☆38Jan 25, 2026Updated 3 weeks ago
- ☆10Aug 5, 2021Updated 4 years ago
- Drug Response Prediction and Biomarker Discovery Using Multi-Modal Deep Learning☆14Apr 24, 2024Updated last year
- Modelling the Multiwavelength Variability of Mrk-335 using Gaussian processes☆12May 30, 2022Updated 3 years ago
- Code for our paper "A Model to Search for Synthesizable Molecules" (https://arxiv.org/abs/1906.05221)☆80Jul 17, 2023Updated 2 years ago
- Simple Vector math library☆11Mar 18, 2017Updated 8 years ago
- ☆12Jun 16, 2025Updated 7 months ago
- Modular Genome Assembly, Annotation and Assessment Pipeline☆20Updated this week
- [ICLR 2025] <MOOSE-Chem: Large Language Models for Rediscovering Unseen Chemistry Scientific Hypotheses>☆50Nov 12, 2025Updated 3 months ago
- Compilation of literature examples of generative drug design that demonstrate experimental validation☆58Jul 3, 2025Updated 7 months ago
- Another Molecular String Representation☆10Updated this week
- lightgbmのfeature-transform（特徴量の非線形化）をすることで、80,000を超える特徴量を線形回帰でも表現できることを示します☆10Nov 7, 2017Updated 8 years ago
- Probabilistic Finite Volume Method based on Affine Gaussian Process inference☆11Jun 10, 2024Updated last year
- ☆12Jan 16, 2024Updated 2 years ago
- PERM GaussianKG☆10Nov 24, 2021Updated 4 years ago
- EXPERIMENTAL implementation of side graph☆10Apr 16, 2015Updated 10 years ago
- ☆10Sep 24, 2024Updated last year
- ☆10Apr 5, 2024Updated last year
- Directly create a bigwig file with signal derived from a sorted and indexed bam file.☆11Jul 7, 2017Updated 8 years ago
- ☆11Nov 11, 2023Updated 2 years ago
- FormulaOne: A dataset of algorithmic problems based on MSO formulas.☆24Aug 14, 2025Updated 6 months ago
- ☆11Oct 25, 2021Updated 4 years ago
- dj takes the cacaphony of java, git, clojure, clojurescript and build tools and mixes it into something harmonious☆23Mar 5, 2014Updated 11 years ago
- ESMDynamic repo☆22Dec 2, 2025Updated 2 months ago
- Inferring selection in cancer sequencing data using ABC and population based simulations☆11Jan 31, 2021Updated 5 years ago
- Hands-on hub to learn techniques to optimize and serve AI models to production the most optimal way.☆14Aug 20, 2025Updated 5 months ago
- Scalable tumor phylogeny inference and validation from single-cell RNA or DNA data☆14Dec 24, 2023Updated 2 years ago