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Application

Discovery Studio 0.8984792780748663 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06760117567262039 Amorphous Cell 0.2874745647750396 Blends 0.0027130906624463036 CASTEP 0.4083201446981687 CDOCKER 0.16176803074836085 CHARMm 0.24067375084784084 COMPASS 0.37553696586027585 COMPASS III 0.0841058105358354 COSMObase 0.0032783178837892833 COSMOconf 0.004634863215012435 COSMOmic 1.1304544426859598E-4 COSMOperm 0.0010174089984173638 COSMOplex 3.3913633280578795E-4 COSMOquick 0.0014695907754917476 COSMOtherm 0.0672620393398146 Cantera 0.0 Catalyst 0.10908885371919512 Classical Simulations 1.0 Conformers 7.913181098801719E-4 Crystallization 0.07698394754691386 DFTB Plus 0.006104453990504182 DMol3 0.1853945286004974 DPD 0.0031652724395206874 Discover 0.004973999547818223 Forcite 0.5468008139271987 GULP 0.02362649785213656 Kinetix 2.2609088853719196E-4 LUDI 0.004747908659281031 LibDock 0.06443590323309971 LigandFit 0.005878363101966991 MCSS 6.782726656115759E-4 MODELER 0.18663802848745195 MesoDyn 0.0010174089984173638 Mesocite 0.003956590549400859 Mesoscale 0.007121862988921547 Modules 0.0 Morphology 0.01797422563870676 ONETEP 0.0012434998869545557 Polymorph 0.0020348179968347276 QMERA 2.2609088853719196E-4 QSAR 0.0014695907754917476 Quantum Mechanics 0.5822970834275378 Reflex 0.056409676690029394 Reflex Plus 5.652272213429799E-4 Semi-empirical 0.007913181098801719 Sorption 0.05539226769161203 Synthia 0.0012434998869545557 TURBOMOLE 4.521817770743839E-4 VAMP 0.0013565453312231518 Visualization 0.7817092471173411 X-Cell 0.0013565453312231518 ZDOCK 0.027583088401537417

Year

2020 0.0 2021 0.07737209568501774 2022 0.19388806226393498 2023 0.29655488153828546 2024 0.7571248712372668 2025 1.0 2026 0.48586471328831404 2027 0.0011445576284765937

Keywords

target 1.0 potential 0.2638575369952345 docking 0.19719087032856786 visualization 0.18289440682217206 analysis 0.18259342864309006 between 0.1527464258841234 novel 0.09169801856032105 energy 0.08873839979934788 cell 0.06260346124905944 binding 0.06039628793579132 promising 0.05176824680210685 activity 0.04504640080260848 stability 0.03215450213192877 experimental 0.028442437923250564 interaction 0.027389014296463506 performance 0.026837220968146475 synthesized 0.024429395535490343 effective 0.016603962879357913 mechanism 0.014998745924253825 development 0.012039127163280662 including 0.010584399297717583 synthesis 0.005768748432405317 protein 0.0019061951341861048 design 0.001003260596940055 chemical 0.0
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