Basic parameters

Find below a subset of parameters that cover most standard scenarios where the Platform PELE can be applied.

• General parameters
• PELE general parameters
• Adaptive PELE parameters
• Residue parametrization
• fragPELE parameters
• Side chain perturbation parameters
• aquaPELE parameters
• Ligand parameters
• Perturbation site parameters
• PELE metrics
• Constraint parameters
• Metal parameters
• Analysis parameters

In case that basic parameters are not flexible enough and do not cover a particular case, do not hesitate to reach us out at pelesupport@nostrumbiodiscovery.com. Besides, you might also find a solution by checking our Advanced Parameters section.