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Application

Discovery Studio 1.0 Materials Studio 0.4868686868686869 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05416191562143672 Amorphous Cell 0.17046750285062715 Blends 5.701254275940707E-4 CASTEP 0.28905359179019385 CDOCKER 0.34549600912200684 CHARMm 0.43272519954389965 COMPASS 0.2633979475484607 COMPASS III 0.05815279361459521 COSMObase 0.0017103762827822121 COSMOconf 0.0 COSMOperm 5.701254275940707E-4 COSMOquick 0.0017103762827822121 COSMOtherm 0.03876852907639681 Catalyst 0.27137970353477764 Classical Simulations 0.9538198403648803 Conformers 0.0 Crystallization 0.04732041049030787 DFTB Plus 0.0017103762827822121 DMol3 0.12884834663625996 DPD 0.0017103762827822121 Discover 5.701254275940707E-4 Forcite 0.3808437856328392 GULP 0.009122006841505131 LUDI 0.007411630558722919 LibDock 0.12542759407069556 LigandFit 0.010832383124287344 MCSS 5.701254275940707E-4 MODELER 0.31413911060433297 MesoDyn 5.701254275940707E-4 Mesocite 0.0017103762827822121 Mesoscale 0.003990877993158495 Morphology 0.00798175598631699 ONETEP 0.0 Polymorph 0.002280501710376283 QSAR 0.0011402508551881414 Quantum Mechanics 0.40992018244013684 Reflex 0.03591790193842646 Reflex Plus 5.701254275940707E-4 Semi-empirical 0.0017103762827822121 Sorption 0.022234891676168756 Synthia 0.0 Visualization 1.0 X-Cell 0.0011402508551881414 ZDOCK 0.033637400228050174

Year

2022 0.008992805755395683 2023 0.4289568345323741 2024 0.7198741007194245 2025 1.0 2026 0.25404676258992803 2027 0.0

Keywords

novel 1.0 target 0.9538152610441767 potential 0.36211512717536815 docking 0.3315484158857653 visualization 0.1963409192324855 analysis 0.17759928603302097 synthesized 0.13609995537706382 promising 0.11958946898705936 synthesis 0.10419455600178491 activity 0.10240963855421686 binding 0.0999553770638108 development 0.0825524319500223 compound 0.07585899152164212 between 0.07072735385988398 design 0.03279785809906292 protein 0.0285586791610888 vitro 0.027666220437304774 drug 0.025881302989736725 effective 0.0214190093708166 therapeutic 0.018072289156626505 stability 0.01717983043284248 potent 0.012048192771084338 inhibition 0.011155734047300312 cell 0.00892458723784025 treatment 0.0
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