Thats a unique idea.You should consider the following idea to enhance your idea so that it would impact uniquely: Protein engineers have long been hard at work to harness biocatalysts as a natural source of regio-, stereo-, and chemoselectivity in order to carry out chemistry (reactions and/or substrates) not previously achieved with these enzymes. The extreme labor demands and exponential number of mutation combinations have induced computational advances in this domain. The first step in our virtual approach is to predict the correct conformations upon mutation of residues (i.e., rebuilding side chains). For this purpose,  opted for a combination of molecular mechanics and statistical data. In this work,  have developed automated computational tools to extract protein structural information and created conformational libraries for each amino acid dependent on a variable number of parameters (e.g., resolution, flexibility, secondary structure).  have also developed the necessary tool to apply the mutation and optimize the conformation accordingly. For side-chain conformation prediction,  obtained overall ave...
['Joshua Pottel', 'Nicolas Moitessier']
I am writing a research paper on a idea Single-Point Mutation with a Rotamer Library Toolkit: Toward Protein Engineering
[{"from": "human", "value": "I am writing a research paper on a idea Single-Point Mutation with a Rotamer Library Toolkit: Toward Protein Engineering"}, {"from": "gpt", "value": "Thats a unique idea.You should consider the following idea to enhance your idea so that it would impact uniquely: Protein engineers have long been hard at work to harness biocatalysts as a natural source of regio-, stereo-, and chemoselectivity in order to carry out chemistry (reactions and/or substrates) not previously achieved with these enzymes. The extreme labor demands and exponential number of mutation combinations have induced computational advances in this domain. The first step in our virtual approach is to predict the correct conformations upon mutation of residues (i.e., rebuilding side chains). For this purpose,  opted for a combination of molecular mechanics and statistical data. In this work,  have developed automated computational tools to extract protein structural information and created conformational libraries for each amino acid dependent on a variable number of parameters (e.g., resolution, flexibility, secondary structure).  have also developed the necessary tool to apply the mutation and optimize the conformation accordingly. For side-chain conformation prediction,  obtained overall ave..."}]