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Application

Discovery Studio 1.0 Materials Studio 0.6348228043143297 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04161849710982659 Amorphous Cell 0.24508670520231213 Blends 0.0011560693641618498 CASTEP 0.1884393063583815 CDOCKER 0.20578034682080926 CHARMm 0.3283236994219653 COMPASS 0.3040462427745665 COMPASS III 0.10867052023121387 COSMObase 0.0023121387283236996 COSMOconf 0.009248554913294798 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.06473988439306358 Catalyst 0.11213872832369942 Classical Simulations 1.0 Crystallization 0.06589595375722543 DFTB Plus 0.0011560693641618498 DMol3 0.07976878612716763 DPD 0.0023121387283236996 Discover 0.003468208092485549 Forcite 0.47861271676300576 GULP 0.006936416184971098 Kinetix 0.0 LUDI 0.0023121387283236996 LibDock 0.08554913294797688 LigandFit 0.0023121387283236996 MODELER 0.2947976878612717 Mesocite 0.0023121387283236996 Mesoscale 0.004624277456647399 Morphology 0.013872832369942197 ONETEP 0.0023121387283236996 Polymorph 0.0 Quantum Mechanics 0.2682080924855491 Reflex 0.047398843930635835 Semi-empirical 0.0011560693641618498 Sorption 0.055491329479768786 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.8335260115606936 ZDOCK 0.03352601156069364

Year

2025 1.0 2026 0.687221396731055 2027 0.0

Keywords

target 1.0 potential 0.34393530997304583 docking 0.291644204851752 analysis 0.24097035040431267 visualization 0.20700808625336928 binding 0.10835579514824797 promising 0.10566037735849057 novel 0.1045822102425876 between 0.09703504043126684 activity 0.08086253369272237 therapeutic 0.06253369272237197 cell 0.04797843665768194 strong 0.03773584905660377 including 0.03719676549865229 stability 0.03018867924528302 synthesized 0.02371967654986523 mechanism 0.020485175202156335 development 0.018867924528301886 synthesis 0.014016172506738544 protein 0.01293800539083558 energy 0.011859838274932614 effective 0.007008086253369272 strategy 0.0037735849056603774 vitro 0.0026954177897574125 silico 0.0
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