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Application

Discovery Studio 1.0 Materials Studio 0.6845260397152492 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05090497737556561 Amorphous Cell 0.23585972850678733 Blends 0.0022624434389140274 CASTEP 0.2528280542986425 CDOCKER 0.21945701357466063 CHARMm 0.34728506787330315 COMPASS 0.29524886877828055 COMPASS III 0.11142533936651584 COSMObase 0.003393665158371041 COSMOconf 0.007918552036199095 COSMOmic 0.0 COSMOperm 5.656108597285068E-4 COSMOplex 5.656108597285068E-4 COSMOtherm 0.06391402714932126 Catalyst 0.09728506787330317 Classical Simulations 1.0 Conformers 5.656108597285068E-4 Crystallization 0.07352941176470588 DFTB Plus 0.003393665158371041 DMol3 0.11990950226244344 DPD 0.0016968325791855204 Discover 0.0022624434389140274 Forcite 0.47002262443438914 GULP 0.010746606334841629 Kinetix 0.0 LUDI 0.002828054298642534 LibDock 0.08993212669683258 LigandFit 0.004524886877828055 MODELER 0.3093891402714932 Mesocite 0.003393665158371041 Mesoscale 0.004524886877828055 Morphology 0.01753393665158371 ONETEP 0.0011312217194570137 Polymorph 0.0022624434389140274 Quantum Mechanics 0.36934389140271495 Reflex 0.051470588235294115 Reflex Plus 0.0 Semi-empirical 0.003959276018099547 Sorption 0.055995475113122174 Synthia 0.0011312217194570137 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.8116515837104072 X-Cell 0.0011312217194570137 ZDOCK 0.040158371040723985

Year

2024 0.0 2025 1.0 2026 0.7418312387791741 2027 0.003231597845601436

Keywords

target 1.0 potential 0.3195080781287678 docking 0.259946949602122 analysis 0.21413069688931757 visualization 0.17771883289124668 between 0.10393055220641427 binding 0.1005546177959971 novel 0.09838437424644321 promising 0.09428502531950808 activity 0.06944779358572462 cell 0.03809983120327948 including 0.03641186399807089 therapeutic 0.03255365324330842 stability 0.032071376898963104 strong 0.03134796238244514 energy 0.0294188570050639 development 0.023872679045092837 protein 0.01904991560163974 synthesized 0.013503737641668677 effective 0.01278032312515071 mechanism 0.012056908608632746 strategy 0.004099348926935134 synthesis 0.0016879672052085846 interaction 0.0012056908608632747 inhibition 0.0
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