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Application

Discovery Studio 0.8276813529149978 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06783709542577332 Amorphous Cell 0.2897408336319121 Blends 0.002388630120625821 CASTEP 0.3954377164696047 CDOCKER 0.14475098530992475 CHARMm 0.23277200525498626 COMPASS 0.3670130180341574 COMPASS III 0.09124567060790637 COSMObase 0.003941239699032604 COSMOconf 0.005016123253314225 COSMOmic 1.1943150603129105E-4 COSMOperm 0.0011943150603129105 COSMOplex 2.388630120625821E-4 COSMOquick 0.0015526095784067838 COSMOtherm 0.06616505434133524 Cantera 0.0 Catalyst 0.09172339663203152 Classical Simulations 1.0 Conformers 7.165890361877463E-4 Crystallization 0.07476412277558821 DFTB Plus 0.005852143795533261 DMol3 0.17520601934790397 DPD 0.0025080616266571123 Discover 0.003463513674907441 Forcite 0.5549982085274096 GULP 0.023289143676101756 Kinetix 2.388630120625821E-4 LUDI 0.002866356144750985 LibDock 0.06150722560611489 LigandFit 0.003702376686970023 MCSS 4.777260241251642E-4 MODELER 0.20255583422906964 MesoDyn 7.165890361877463E-4 Mesocite 0.0032246506628448583 Mesoscale 0.005971575301564553 Modules 0.0 Morphology 0.017675862892631077 ONETEP 0.0011943150603129105 Polymorph 0.002149767108563239 QMERA 1.1943150603129105E-4 QSAR 9.554520482503284E-4 Quantum Mechanics 0.5594171742505673 Reflex 0.05410247223217485 Reflex Plus 0.0010748835542816195 Semi-empirical 0.007285321867908754 Sorption 0.058402006449301325 Synthia 0.0014331780723754925 TURBOMOLE 5.971575301564553E-4 VAMP 0.0010748835542816195 Visualization 0.6990326048011466 X-Cell 0.0015526095784067838 ZDOCK 0.024244595724352083

Year

2023 0.13267991650785008 2024 0.49786732008349216 2025 1.0 2026 0.3856974317088665 2027 0.0

Keywords

target 1.0 potential 0.283290545819846 analysis 0.1968411653086282 docking 0.19204152249134948 visualization 0.16525281839491016 between 0.16168099118205156 energy 0.10023440116084384 novel 0.09761134055140083 promising 0.07071101685455966 cell 0.06870186404732671 binding 0.059325817613572945 performance 0.04660118316776426 stability 0.04269449715370019 activity 0.041187632548275475 experimental 0.033039401718941847 synthesized 0.026174796294229266 interaction 0.02528183949101462 including 0.021710012278156044 effective 0.021207724076347807 mechanism 0.01986828887152584 development 0.018138185065297466 enhanced 0.008706328831342784 synthesis 0.0035160174126576626 design 0.002567250809242103 protein 0.0
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