As molecular data generation and frontier model intelligence grows, new approaches to data analysis ... Protein structure (AlphaFold, cryo-EM, docking) * High-throughput antibody/binding screens * PK/PD ...
As molecular data generation and frontier model intelligence grows, new approaches to data analysis ... Protein structure (AlphaFold, cryo-EM, docking) * High-throughput antibody/binding screens * PK/PD ...
Research Investigator, Computational Chemistry
Boulder, CO · On-site
$210K/yr
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structure-based and ligand-based drug design methods-including docking, protein modeling, and ...
Research Investigator, Computational Chemistry
Boulder, CO · On-site
$210K/yr
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structure-based and ligand-based drug design methods-including docking, protein modeling, and ...
CADD Scientist / Senior CADD Scientist
San Francisco, CA · On-site +1
$116K - $147K/yr
... docking, pharmacophore, shape and 3D-similarity, MD, FEP, and QSAR - choosing appropriate physics- and ML-based approaches for each question. • Design, enumerate, and prioritise molecules and ...
CADD Scientist / Senior CADD Scientist
San Francisco, CA · On-site +1
$116K - $147K/yr
... docking, pharmacophore, shape and 3D-similarity, MD, FEP, and QSAR - choosing appropriate physics- and ML-based approaches for each question. • Design, enumerate, and prioritise molecules and ...
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structure-based and ligand-based drug design methods-including docking, protein modeling, and ...
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structure-based and ligand-based drug design methods-including docking, protein modeling, and ...
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structurebased and ligandbased drug design methods-including docking, protein modeling, and a ...
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structurebased and ligandbased drug design methods-including docking, protein modeling, and a ...
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structurebased and ligandbased drug design methods-including docking, protein modeling, and a ...
We are seeking an Experienced Computational Chemist who thrives at the intersection of molecular ... Apply structurebased and ligandbased drug design methods-including docking, protein modeling, and a ...
Apply structure-based and ligand-based design approaches to guide compound design, including docking, molecular dynamics, pharmacophore modeling, QSAR, scaffold hopping, virtual screening, FEP/free ...
Apply structure-based and ligand-based design approaches to guide compound design, including docking, molecular dynamics, pharmacophore modeling, QSAR, scaffold hopping, virtual screening, FEP/free ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Expert level use of structure-based small molecule drug discovery software tools including protein preparation, docking, FEP, QM, conformer selection. (Schrodinger suite, OpenEye, MOE, etc) * Ability ...
Expert level use of structure-based small molecule drug discovery software tools including protein preparation, docking, FEP, QM, conformer selection. (Schrodinger suite, OpenEye, MOE, etc) * Ability ...
Assistant Staff Scientist
Portland, OR · On-site
$68K - $113K/yr
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
$68K - $113K/yr
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Principal Scientist (Computational Chemistry)
South San Francisco, CA · On-site +1
$144K - $269K/yr
Deep knowledge of computational chemistry principles and general molecular modeling techniques (e.g., docking, molecular simulation and dynamics, quantum mechanics, ligand- and structure-based design)
Principal Scientist (Computational Chemistry)
South San Francisco, CA · On-site +1
$144K - $269K/yr
Deep knowledge of computational chemistry principles and general molecular modeling techniques (e.g., docking, molecular simulation and dynamics, quantum mechanics, ligand- and structure-based design)
... molecules that weren't feasible until now. New AI models are quickly eclipsing physics-based tools ... Configure and deploy models (e.g. protein structure, docking, generative models) against real ...
... molecules that weren't feasible until now. New AI models are quickly eclipsing physics-based tools ... Configure and deploy models (e.g. protein structure, docking, generative models) against real ...
Principal Scientist (Computational Chemistry)
South San Francisco, CA · On-site
$144K - $269K/yr
Deep knowledge of computational chemistry principles and general molecular modeling techniques (e.g., docking, molecular simulation and dynamics, quantum mechanics, ligand- and structure-based design)
Principal Scientist (Computational Chemistry)
South San Francisco, CA · On-site
$144K - $269K/yr
Deep knowledge of computational chemistry principles and general molecular modeling techniques (e.g., docking, molecular simulation and dynamics, quantum mechanics, ligand- and structure-based design)
Staff CADD Scientist
San Francisco, CA · On-site +1
We are creating a future where the synthesis of previously unimaginable molecules, drugs, and ... Deploy and advance methods across the CADD stack - docking, pharmacophore, shape and 3D-similarity ...
Staff CADD Scientist
San Francisco, CA · On-site +1
We are creating a future where the synthesis of previously unimaginable molecules, drugs, and ... Deploy and advance methods across the CADD stack - docking, pharmacophore, shape and 3D-similarity ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Assistant Staff Scientist
Portland, OR · On-site
Experience with molecular biology techniques, in silico docking, molecular simulations, microbiology, materials science * High-quality peer-reviewed publications * Grant writing experience * Small ...
Technical Development Principal Scientist - Computational Biophysics
South San Francisco, CA · On-site
$120K - $224K/yr
... Molecular dynamics simulation package (e.g., AMBER, GROMACS, NAMD, Rosetta). * Familiarity with MOE, Schrodinger, docking tools, homology modeling, quantum mechanics, and structural rendering tools.
Technical Development Principal Scientist - Computational Biophysics
South San Francisco, CA · On-site
$120K - $224K/yr
... Molecular dynamics simulation package (e.g., AMBER, GROMACS, NAMD, Rosetta). * Familiarity with MOE, Schrodinger, docking tools, homology modeling, quantum mechanics, and structural rendering tools.
$48K - $65K/yr
... molecular modeling and docking software o Must be detail oriented and have ability to keep organized and accurate records Conditions of Employment: To promote the highest levels of health and well ...
$48K - $65K/yr
... molecular modeling and docking software o Must be detail oriented and have ability to keep organized and accurate records Conditions of Employment: To promote the highest levels of health and well ...
... molecular modeling, systems biology, protein design, LLM/agentic workflows), and ensure rigor in ... Generative modeling (diffusion/flow/VAEs) for sequences, graphs, or 3D structures; docking ...
... molecular modeling, systems biology, protein design, LLM/agentic workflows), and ensure rigor in ... Generative modeling (diffusion/flow/VAEs) for sequences, graphs, or 3D structures; docking ...
Molecular Docking information
What is a Molecular Docking job?
A molecular docking job involves using computational techniques to predict the interaction between molecules, such as a drug candidate and a target protein. Researchers in this field use specialized software to model binding affinities, optimize molecular structures, and analyze potential therapeutic effects. This role is often found in pharmaceutical research, bioinformatics, and drug discovery, requiring expertise in molecular modeling, chemistry, and computational biology.
What are the key skills and qualifications needed to thrive in the Molecular Docking position, and why are they important?
To thrive in a Molecular Docking role, you need strong expertise in computational chemistry, structural biology, and molecular modeling, often supported by an advanced degree in a related field. Familiarity with molecular docking software (such as AutoDock or Schrödinger Suite), programming languages (like Python or R), and experience with high-performance computing are typically required. Attention to detail, analytical thinking, and effective communication are valuable soft skills for collaborating and presenting complex findings. These capabilities are essential for accurately predicting molecular interactions, driving scientific discovery, and contributing to successful multidisciplinary projects.
What does a typical day look like for someone working in Molecular Docking?
A typical day in Molecular Docking often involves running computational simulations to predict how small molecules interact with biological targets, analyzing and interpreting the resulting data, and preparing reports or presentations for research teams. You may also spend time troubleshooting software issues, developing scripts to automate workflows, and staying up to date with the latest scientific literature. Collaboration is common, as you’ll likely work closely with medicinal chemists, structural biologists, and other computational scientists to refine hypotheses and guide experimental design. This multifaceted environment provides opportunities to continually learn and apply new techniques, making the day-to-day work both intellectually stimulating and impactful.
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Full-time
Posted 23 days ago
Job description
We're seeking a Bioinformatics Engineer for Therapeutics to join our therapeutics bench, working at the frontier of what artificial intelligence can achieve in biology.
About the Role
You will contribute to our technical approach for evaluating how AI agents reason through complex biologics therapeutics datasets. Working with software engineers and biologists, you'll build ground-truth benchmark datasets-drawn from real antibody and protein discovery programs-that rigorously test whether agents can perform the critical decision-making steps that human scientists execute.
Your hands-on expertise in variant ranking, enrichment analysis, and advancement prioritization will define how we measure agent capability in therapeutic discovery.
Requirements
- 2+ years hands-on experience with biologics discovery or development (antibody engineering, protein engineering, or cell/molecular biology-driven target validation)
- Experience interpreting binding kinetics (SPR/BLI), biophysical stability data, and/or cell-based potency assays
- Proficiency in Python and/or R for data analysis & visualization
- Familiarity with at least one of:
- Antibody optimization (CDR engineering, VH/VL pairing, variant screening)
- Protein structure (AlphaFold, cryo-EM, docking)
- High-throughput antibody/binding screens
- PK/PD modeling for biologics (target occupancy, half-life, clearance) -
- Bioprocess/manufacturability constraints
Nice-to-Have
- Experience with immunogenicity risk assessment
- Hands-on work with potency assay design (ELISA, cell-based, biochemical)
- CMC/GMP-adjacent knowledge
Compensation & Logistics
- OTE 120k - 180k - Performance based pay
- Free meals onsite (lunch and dinner)
- Waterfront office in China Basin, San Francisco
- Full-time, in-person (can be remote)
About LatchBio
Sourced by ZipRecruiter
Industry
Biotechnology research and development
Company size
11 - 50 Employees
Headquarters location
San Francisco, CA, US
Year founded
2021