Obtaining QM/MM binding free energies in the SAMPL8 drugs of abuse challenge: indirect approaches

por Hudson, Phillip S., Aviat, Félix, Meana-Pañeda, Rubén, Warrensford, Luke, Pollard, Benjamin C., Prasad, Samarjeet, Jones, Michael R., Woodcock, H. Lee, Brooks, Bernard R.
Publicado 2022

A draft map of the human proteome

por Kim, Min-Sik, Pinto, Sneha M., Getnet, Derese, Nirujogi, Raja Sekhar, Manda, Srikanth S., Chaerkady, Raghothama, Madugundu, Anil K., Kelkar, Dhanashree S., Isserlin, Ruth, Jain, Shobhit, Thomas, Joji K., Muthusamy, Babylakshmi, Leal-Rojas, Pamela, Kumar, Praveen, Sahasrabuddhe, Nandini A., Balakrishnan, Lavanya, Advani, Jayshree, George, Bijesh, Renuse, Santosh, Selvan, Lakshmi Dhevi N., Patil, Arun H., Nanjappa, Vishalakshi, Radhakrishnan, Aneesha, Prasad, Samarjeet, Subbannayya, Tejaswini, Raju, Rajesh, Kumar, Manish, Sreenivasamurthy, Sreelakshmi K., Marimuthu, Arivusudar, Sathe, Gajanan J., Chavan, Sandip, Datta, Keshava K., Subbannayya, Yashwanth, Sahu, Apeksha, Yelamanchi, Soujanya D., Jayaram, Savita, Rajagopalan, Pavithra, Sharma, Jyoti, Murthy, Krishna R., Syed, Nazia, Goel, Renu, Khan, Aafaque A., Ahmad, Sartaj, Dey, Gourav, Mudgal, Keshav, Chatterjee, Aditi, Huang, Tai-Chung, Zhong, Jun, Wu, Xinyan, Shaw, Patrick G., Freed, Donald, Zahari, Muhammad S., Mukherjee, Kanchan K., Shankar, Subramanian, Mahadevan, Anita, Lam, Henry, Mitchell, Christopher J., Shankar, Susarla Krishna, Satishchandra, Parthasarathy, Schroeder, John T., Sirdeshmukh, Ravi, Maitra, Anirban, Leach, Steven D., Drake, Charles G., Halushka, Marc K., Prasad, T. S. Keshava, Hruban, Ralph H., Kerr, Candace L., Bader, Gary D., Iacobuzio-Donahue, Christine A., Gowda, Harsha, Pandey, Akhilesh
Publicado 2014