by Tamarind Bio
Design and optimize proteins, peptides, and small molecules using AI and physics-based methods—250+ computational tools including AlphaFold and RFdiffusion, no setup required.
Drug Discovery & Molecular Design
by bitBiome
AI-driven enzyme discovery and strain engineering for biomanufacturing, reducing development timelines from years to weeks.
Drug Discovery & Molecular Design
by Iktos
Generative AI for de novo drug design, creating novel, synthetically accessible molecules that rapidly converge toward drug candidates.
Drug Discovery & Molecular Designby Iktos
AI-driven retrosynthesis planning that transforms target compounds into commercially available starting materials in seconds.
Drug Discovery & Molecular Design
by BioStrand
AI-driven biointelligence integrating molecular data, structure, and function to accelerate biologics discovery from target to clinic.
Drug Discovery & Molecular Design
by VeraChem
Protein-ligand binding free energy calculation with fully flexible ligands and receptors, including entropy and solvation effects.
Drug Discovery & Molecular Designby VeraChem
Fast protein-ligand docking and scoring with flexible ligands and receptor side chains.
Drug Discovery & Molecular Designby VeraChem
2D-to-3D conformational search for drug-like compounds with symmetry-aware duplicate filtering.
Drug Discovery & Molecular Designby VeraChem
2D chemical drawing with templates, stereochemistry checking, and 1-click 2D-to-3D conversion.
Drug Discovery & Molecular Designby VeraChem
Superimpose congeneric ligands on a reference structure using maximum common substructure mapping for drug discovery workflows.
Drug Discovery & Molecular Designby VeraChem
Fast partial atomic charge calculation for drug-like compounds with ab initio-level accuracy in ~0.1 seconds per molecule.
Drug Discovery & Molecular Designby VeraChem
Conformation deduplication with global and local chemical symmetry detection for molecular structure sets.
Drug Discovery & Molecular Designby VeraChem
Symmetry-corrected RMSD calculation for molecular conformations with optional superposition.
Drug Discovery & Molecular Designby VeraChem
3D molecular viewer for VCharge and VConf outputs, and SDfiles from other programs.
Drug Discovery & Molecular Design
by EVQLV
In silico antibody design and optimization using sequence-driven modeling to accelerate therapeutic candidate discovery.
Drug Discovery & Molecular Design
by Boltz
AI-powered molecular design and screening for drug discovery, from target definition to lead optimization.
Drug Discovery & Molecular Design
by Polaris Quantum
Quantum-accelerated molecular optimization exploring 10^30 chemical space to identify and optimize drug candidates in days.
Drug Discovery & Molecular Design
by Inductive Bio
AI chemistry assistant automating operations, data analysis, and compound optimization for medicinal chemists.
Drug Discovery & Molecular Design
by Deepflare
T-cell immunogenicity prediction for antigen design in vaccines and immunotherapies, with 12x greater accuracy than standard binding affinity models.
Drug Discovery & Molecular Design
by Inventum.ai
Generative AI for de novo ligand design, binding site identification, and ADMET prediction in drug discovery.
Drug Discovery & Molecular Design