Results for “clindoc”

Predict 3D binding poses of small molecule ligands to protein targets using diffusion-based molecular docking, supporting single complexes, batch processing, and virtual screening.

Therapeutics Data Commons. Conjuntos de dados prontos para IA em descoberta de drogas (ADME, toxicidade, DTI), benchmarks, divisões de scaffold, oráculos moleculares, para ML terapêutico e predição farmacológica.

We need to output a SKILL.md file with the specified format.

Access ClinPGx pharmacogenomics data (the successor to PharmGKB) to query gene-drug interactions, CPIC/DPWG dosing guidelines, drug labels, and pharmacogene records. Use when interpreting pharmacogenes (CYP2D6, CYP2C19, TPMT, DPYD, SLCO1B1), looking up genotype-guided drug dosing, checking PGx drug-safety associations (e.g. HLA-B*57:01 and abacavir), or supporting precision medicine and clinical pharmacogenomics decisions. For star-allele definitions/frequencies see PharmVar; for germline/somatic variant pathogenicity see alterlab-clinvar. Part of the AlterLab Academic Skills suite.

Draft a legal document — a pleading, motion, brief section, or contract clause — with verified citations, flagged assumptions, and mandatory supervisor review before filing.

Cheminformatics toolkit for fine-grained molecular control. SMILES/SDF parsing, descriptors (MW, LogP, TPSA), fingerprints, substructure search, 2D/3D generation, similarity, reactions. For standard workflows with simpler interface, use datamol (wrapper around RDKit). Use rdkit for advanced control, custom sanitization, specialized algorithms.

Onboard a new clinic student onto a matter and the clinic's systems fast, with supervision and confidentiality from day one.

Use when simulating stochastic folding kinetics of single-stranded nucleic acids, computing first passage times between structures, or analyzing RNA/DNA folding trajectories.

Post-execution skill crystallization and learning engine updates for WinDAGs. Runs after successful execution to update Thompson sampling parameters, track method quality, detect monster-barring, log near-miss events, and signal Kuhnian crises. Activate on "curator", "learning update", "skill crystallization", "Thompson sampling", "monster-barring", "near-miss", "Kuhnian crisis", "post-execution learning". NOT for pre-execution risk scanning (use windags-premortem), retrospective analysis (use windags-looking-back), or DAG construction (use windags-architect).