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Iwona E. Weidlich

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Journal Articles

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2016
[j3]
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  - journals/jcc/WeidlichF16
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Iwona E. Weidlich, Igor V. Filippov:
Using the gini coefficient to measure the chemical diversity of small-molecule libraries. J. Comput. Chem. 37(22): 2091-2097 (2016)
2015
[j2]
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Iwona E. Weidlich, Yuri Pevzner, Benjamin T. Miller, Igor V. Filippov, H. Lee Woodcock III, Bernard R. Brooks:
Development and implementation of (Q)SAR modeling within the CHARMMing web-user interface. J. Comput. Chem. 36(1): 62-67 (2015)
2012
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Markus Sitzmann, Iwona E. Weidlich, Igor V. Filippov, Chenzhong Liao, Megan L. Peach, Wolf-Dietrich Ihlenfeldt, Rajeshri G. Karki, Yulia V. Borodina, Raul E. Cachau, Marc C. Nicklaus:
PDB Ligand Conformational Energies Calculated Quantum-Mechanically. J. Chem. Inf. Model. 52(3): 739-756 (2012)

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