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Application

Discovery Studio 0.873424234628248 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06818181818181818 Amorphous Cell 0.2850649350649351 Blends 0.0016233766233766235 CASTEP 0.3594155844155844 CDOCKER 0.15844155844155844 CHARMm 0.25227272727272726 COMPASS 0.3600649350649351 COMPASS III 0.09415584415584416 COSMObase 0.0035714285714285713 COSMOconf 0.00551948051948052 COSMOmic 0.0 COSMOperm 9.74025974025974E-4 COSMOquick 0.001948051948051948 COSMOtherm 0.06818181818181818 Catalyst 0.07012987012987013 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07175324675324675 DFTB Plus 0.00551948051948052 DMol3 0.15681818181818183 DPD 0.002922077922077922 Discover 0.0022727272727272726 Forcite 0.5487012987012987 GULP 0.024675324675324677 Kinetix 0.0 LUDI 0.0035714285714285713 LibDock 0.0659090909090909 LigandFit 0.003246753246753247 MODELER 0.24545454545454545 MesoDyn 0.0016233766233766235 Mesocite 0.0012987012987012987 Mesoscale 0.005844155844155844 Modules 0.0 Morphology 0.01818181818181818 ONETEP 3.246753246753247E-4 Polymorph 0.0012987012987012987 QSAR 0.0012987012987012987 Quantum Mechanics 0.5055194805194805 Reflex 0.05097402597402598 Reflex Plus 0.001948051948051948 Semi-empirical 0.007142857142857143 Sorption 0.052597402597402594 Synthia 0.001948051948051948 TURBOMOLE 3.246753246753247E-4 VAMP 0.0012987012987012987 Visualization 0.6376623376623377 X-Cell 0.0016233766233766235 ZDOCK 0.026298701298701297

Year

2025 0.0

Keywords

target 1.0 potential 0.3069515498043936 analysis 0.20087270538669877 docking 0.19304845019560637 between 0.15693650315979538 visualization 0.1376767980740295 novel 0.09690039121275955 energy 0.09133313271140536 promising 0.0898284682515799 binding 0.07117062894974421 cell 0.06695756846223293 stability 0.04634366536262414 performance 0.043785735780920855 including 0.043334336442973215 activity 0.043033403551008126 experimental 0.026482094492928078 development 0.02572976226301535 interaction 0.021516701775504063 strong 0.02016250376166115 effective 0.01865783930183569 synthesized 0.0183569064098706 enhanced 0.014745711706289497 mechanism 0.012187782124586218 synthesis 0.0 therapeutic 0.0
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