Company Filing History:
Years Active: 2020
Title: Innovations by Yuqing Deng in Free Energy Calculations
Introduction
Yuqing Deng is an accomplished inventor based in New York, NY (US). He has made significant contributions to the field of computational chemistry, particularly in the area of free energy calculations. His innovative methods have the potential to enhance the understanding of molecular interactions.
Latest Patents
Yuqing Deng holds a patent titled "Methods and systems for calculating free energy differences using an alchemical restraint potential." This patent describes a method for computing the free energy difference between a reference molecule and a target molecule. The target molecule is characterized by a common set of atoms, P, and an additional set of atoms. The method involves applying a potential to restrain the interaction of the additional atomic component from the set of atoms P with the common set of atoms P in the initial state. It also includes determining one or more transition states along a transformation path between the initial state and the target state. The restrain potential is scaled correspondingly along the transformation path until it becomes zero when the corresponding end state is reached. Finally, the free energy difference is calculated using a value obtained along the transformation path from the initial state to the target state. Yuqing Deng has 1 patent to his name.
Career Highlights
Yuqing Deng is currently employed at Schrodinger, LLC, where he continues to develop innovative solutions in computational chemistry. His work is instrumental in advancing the understanding of molecular dynamics and interactions.
Collaborations
Yuqing has collaborated with notable colleagues, including Lingle Wang and Yujie Wu, who contribute to the dynamic research environment at Schrodinger, LLC.
Conclusion
Yuqing Deng's contributions to the field of computational chemistry, particularly through his patented methods for calculating free energy differences, highlight his innovative spirit and dedication to advancing scientific knowledge. His work continues to influence the understanding of molecular interactions and dynamics.