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Application

Discovery Studio 0.9799287795403043 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06321839080459771 Amorphous Cell 0.2806183115338882 Blends 0.002179944510503369 CASTEP 0.33828775267538647 CDOCKER 0.16845025762980578 CHARMm 0.2689258818866429 COMPASS 0.33729686880697585 COMPASS III 0.10503369005152596 COSMObase 0.004161712247324614 COSMOconf 0.006738010305192232 COSMOmic 0.0 COSMOperm 3.9635354736424893E-4 COSMOplex 1.9817677368212446E-4 COSMOquick 0.0011890606420927466 COSMOtherm 0.06757827982560444 Catalyst 0.08045977011494253 Classical Simulations 1.0 Conformers 3.9635354736424893E-4 Crystallization 0.07094728497820056 DFTB Plus 0.0047562425683709865 DMol3 0.15180340864050734 DPD 0.002179944510503369 Discover 0.0031708283789139914 Forcite 0.525564803804994 GULP 0.019619500594530322 Kinetix 1.9817677368212446E-4 LUDI 0.003963535473642489 LibDock 0.07094728497820056 LigandFit 0.004161712247324614 MCSS 3.9635354736424893E-4 MODELER 0.24851367419738407 MesoDyn 7.927070947284979E-4 Mesocite 0.0023781212841854932 Mesoscale 0.005152596115735236 Modules 0.0 Morphology 0.016646848989298454 ONETEP 9.908838684106222E-4 Polymorph 0.0017835909631391202 QMERA 0.0 QSAR 5.945303210463733E-4 Quantum Mechanics 0.4817677368212446 Reflex 0.05112960760998811 Reflex Plus 5.945303210463733E-4 Semi-empirical 0.006341656757827983 Sorption 0.05766944114149822 Synthia 0.0011890606420927466 TURBOMOLE 3.9635354736424893E-4 VAMP 0.0011890606420927466 Visualization 0.6928260007927071 X-Cell 0.0015854141894569957 ZDOCK 0.02992469282600079

Year

2023 0.0 2024 0.42170947612828324 2025 1.0 2026 0.5080539834566826 2027 0.00130605137135394

Keywords

target 1.0 potential 0.27714110751465315 docking 0.19622080307934564 analysis 0.18930977167351937 visualization 0.1453941037529525 between 0.13550870440031493 novel 0.08774385443093342 promising 0.07435919867028257 energy 0.0714723121336716 binding 0.06386142944624268 cell 0.057037879450616745 activity 0.0420785583063599 performance 0.03438019420873065 stability 0.032105677543522004 including 0.018808503193071473 development 0.014259469862654186 effective 0.014259469862654186 synthesized 0.012684804479048203 experimental 0.012334878838246872 mechanism 0.01224739742804654 interaction 0.008310733969031581 enhanced 0.005948735893622605 strong 0.002624442306009973 protein 9.622955122036567E-4 design 0.0
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